2-[4,6-dimethoxy-1-(phenylmethyl)indol-3-yl]ethanoic acid

Systemtic Name: 2-[4,6-dimethoxy-1-(phenylmethyl)indol-3-yl]ethanoic acid Openeye Name: 2-(1-benzyl-4,6-dimethoxy-indol-3-yl)acetic acid CAS Name: 2-[4,6-dimethoxy-1-(phenylmethyl)-3-indolyl]acetic acid IUPAC Name: 2-(1-benzyl-4,6-dimethoxyindol-3-yl)acetic acid Traditional Name: 2-(1-benzyl-4,6-dimethoxy-indol-3-yl)acetic acid Formula: C19H19NO4 MolecularWeight: 325.35846

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C2C(=C1)N(C=C2CC(=O)O)CC3=CC=CC=C3)OC

Isomeric SMILES

COC1=CC(=C2C(=C1)N(C=C2CC(=O)O)CC3=CC=CC=C3)OC

InChI

InChI=1S/C19H19NO4/c1-23-15-9-16-19(17(10-15)24-2)14(8-18(21)22)12-20(16)11-13-6-4-3-5-7-13/h3-7,9-10,12H,8,11H2,1-2H3,(H,21,22)