Molecule ID: 589098

IUPAC Name: methyl 1H-indole-3-carboxylate

Description: The molecule is the methyl ester of indole-3-carboxylic acid. It has a role as a metabolite. It is a member of indoles and a methyl ester. It derives from an indole-3-carboxylic acid.

SMILES: COC(=O)c1c[nH]c2ccccc12

SELFIES: [C][O][C][=Branch1][C][=O][C][=C][NH1][C][=C][C][=C][C][=C][Ring1][=Branch2][Ring1][=Branch1]

InChI: InChI=1S/C10H9NO2/c1-13-10(12)8-6-11-9-5-3-2-4-7(8)9/h2-6,11H,1H3

Molecular Properties:
- Polar Surface Area: 42.1 Ų
- LogP: 2.6