3-methoxy-1-(phenylmethyl)indole-2-carboxylic acid

Systemtic Name: 3-methoxy-1-(phenylmethyl)indole-2-carboxylic acid Openeye Name: 1-benzyl-3-methoxy-indole-2-carboxylic acid CAS Name: 3-methoxy-1-(phenylmethyl)-2-indolecarboxylic acid IUPAC Name: 1-benzyl-3-methoxyindole-2-carboxylic acid Traditional Name: 1-benzyl-3-methoxy-indole-2-carboxylic acid Formula: C17H15NO3 MolecularWeight: 281.3059

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(N(C2=CC=CC=C21)CC3=CC=CC=C3)C(=O)O

Isomeric SMILES

COC1=C(N(C2=CC=CC=C21)CC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C17H15NO3/c1-21-16-13-9-5-6-10-14(13)18(15(16)17(19)20)11-12-7-3-2-4-8-12/h2-10H,11H2,1H3,(H,19,20)