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

Systemtic Name: 5-methoxy-1-(phenylmethyl)indole-2-carboxylic acid Openeye Name: 1-benzyl-5-methoxy-indole-2-carboxylic acid CAS Name: 5-methoxy-1-(phenylmethyl)-2-indolecarboxylic acid IUPAC Name: 1-benzyl-5-methoxyindole-2-carboxylic acid Traditional Name: 1-benzyl-5-methoxy-indole-2-carboxylic acid Formula: C17H15NO3 MolecularWeight: 281.3059

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N(C(=C2)C(=O)O)CC3=CC=CC=C3

Isomeric SMILES

COC1=CC2=C(C=C1)N(C(=C2)C(=O)O)CC3=CC=CC=C3

InChI

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