methyl 7-(diethylamino)-2'-methylspiro(2H-1-benzopyran-2,3'-(3H)naphtho(2,1-b)pyran)-5'-carboxylate
Basic information
- CAS
51988-29-5- Standard SMILES
CCN(CC)c1ccc2c(c1)OC1(C=C2)Oc2c(C(=O)OC)cc3ccccc3c2C=C1C- InChIKey
ISTVAESNCSYQNV-UHFFFAOYSA-N- Molecular formula
- C28H27NO4
- Average molar mass
- 441.5 g/mol
- Monoisotopic mass
- 441.19400834
Names & identifiers
- Preferred name
- methyl 7-(diethylamino)-2'-methylspiro(2H-1-benzopyran-2,3'-(3H)naphtho(2,1-b)pyran)-5'-carboxylate
- IUPAC
- methyl 7'-(diethylamino)-2-methylspiro[benzo[f]chromene-3,2'-chromene]-5-carboxylate
- English name
- methyl 7-(diethylamino)-2'-methylspiro[2H-1-benzopyran-2,3'-[3H]naphtho[2,1-b]pyran]-5'-carboxylate
- Molecular formula
- C28H27NO4
- Molecular weight
- 441.52
Names & synonyms
EINECS 257-586-851988-29-5Methyl 7-(diethylamino)-2'-methylspiro(2H-1-benzopyran-2,3'-(3H)naphtho(2,1-b)pyran)-5'-carboxylateMethyl 7-(diethylamino)-2'-methylspiro[2H-1-benzopyran-2,3'-[3H]naphtho[2,1-b]pyran]-5'-carboxylateRefChem:157732257-586-8DTXSID30966307ISTVAESNCSYQNV-UHFFFAOYSA-NNS00060079Methyl 7-(diethylamino)-2'-methylspiro[[1]benzopyran-2,3'-naphtho[2,1-b]pyran]-5'-carboxylateMethyl 7-(diethylamino)-2'-methylspiro[1-benzopyran-2,3'-naphtho[2,1-b]pyran]-5'-carboxylate7-(Diethylamino)-2'-methylspiro[2H-1-benzopyran-2,3'-[3H]naphtho[2,1-b]pyran]-5'-carboxylic acid methyl ester
Show more names
Spiro[2H-1-benzopyran-2,3'-[3H]naphtho[2,1-b]pyran]-5'-carboxylic acid, 7-(diethylamino)-2'-methyl-, methyl ester
Properties
Computed structural properties
- XLogP
- 6.3
- Topological polar surface area
- 48 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 789
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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