Basic information
- Standard SMILES
COC(=O)C(=O)c1c[nH]c2cc(OCc3ccccc3)ccc12- InChIKey
MIZNLOQJTYKTDH-UHFFFAOYSA-N- Molecular formula
- C18H15NO4
- Average molar mass
- 309.3 g/mol
- Monoisotopic mass
- 309.10010796
Names & identifiers
- Preferred name
- (6-Benzyloxy-1H-indol-3-yl)-oxo-acetic acid methyl ester
- IUPAC
- methyl 2-oxo-2-(6-phenylmethoxy-1H-indol-3-yl)acetate
Names & synonyms
(6-Benzyloxy-1H-indol-3-yl)-oxo-acetic acid methyl esterMFCD09910223408355-02-2(6-benzyloxy-1H-indol-3-yl}-oxo-acetic acid methyl esterSCHEMBL2084401MIZNLOQJTYKTDH-UHFFFAOYSA-NB67488H54340methyl 2-(6-benzyloxy-1H-indol-3-yl)-2-oxo-acetatemethyl 2-oxo-2-(6-phenylmethoxy-1H-indol-3-yl)acetate
Database identifiers
- PubChem CID
- 34181007
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 68.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 433
Related reactions
8 records
Linked notes
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