Basic information
- CAS
42773-68-2- Standard SMILES
CCN(CC)CCCN1C(=O)C(OC)(c2ccccc2)c2ccccc21.O=C(O)/C=C/C(=O)O- InChIKey
UVJHTKCDPUGPSC-WLHGVMLRSA-N- Molecular formula
- C26H32N2O6
- Average molar mass
- 468.5 g/mol
- Monoisotopic mass
- 468.22603674
Names & identifiers
- Preferred name
- 2H-Indol-2-one, 1,3-dihydro-1-(3-(diethylamino)propyl)-3-methoxy-3-phenyl-, (E)-2-butenedioate (1:1)
- IUPAC
- (E)-but-2-enedioic acid;1-[3-(diethylamino)propyl]-3-methoxy-3-phenylindol-2-one
Names & synonyms
42773-68-22H-Indol-2-one, 1,3-dihydro-1-(3-(diethylamino)propyl)-3-methoxy-3-phenyl-, (E)-2-butenedioate (1:1)RefChem:10652431,3-Dihydro-1-(3-(diethylamino)propyl)-3-methoxy-3-phenyl-2H-indol-2-one fumarate
Database identifiers
- CAS
42773-68-2- PubChem CID
- 6445845
Properties
Computed structural properties
- Topological polar surface area
- 107 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 10
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 578
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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