2-[6-methoxy-3-(phenylmethyl)indol-1-yl]butanoic acid

Systemtic Name: 2-[6-methoxy-3-(phenylmethyl)indol-1-yl]butanoic acid Openeye Name: 2-(3-benzyl-6-methoxy-indol-1-yl)butanoic acid CAS Name: 2-[6-methoxy-3-(phenylmethyl)-1-indolyl]butanoic acid IUPAC Name: 2-(3-benzyl-6-methoxyindol-1-yl)butanoic acid Traditional Name: 2-(3-benzyl-6-methoxy-indol-1-yl)butyric acid Formula: C20H21NO3 MolecularWeight: 323.38564

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)N1C=C(C2=C1C=C(C=C2)OC)CC3=CC=CC=C3

Isomeric SMILES

CCC(C(=O)O)N1C=C(C2=C1C=C(C=C2)OC)CC3=CC=CC=C3

InChI

InChI=1S/C20H21NO3/c1-3-18(20(22)23)21-13-15(11-14-7-5-4-6-8-14)17-10-9-16(24-2)12-19(17)21/h4-10,12-13,18H,3,11H2,1-2H3,(H,22,23)