3-[5-methoxy-2-methyl-1-(phenylmethyl)indol-3-yl]propanoic acid

Systemtic Name: 3-[5-methoxy-2-methyl-1-(phenylmethyl)indol-3-yl]propanoic acid Openeye Name: 3-(1-benzyl-5-methoxy-2-methyl-indol-3-yl)propanoic acid CAS Name: 3-[5-methoxy-2-methyl-1-(phenylmethyl)-3-indolyl]propanoic acid IUPAC Name: 3-(1-benzyl-5-methoxy-2-methylindol-3-yl)propanoic acid Traditional Name: 3-(1-benzyl-5-methoxy-2-methyl-indol-3-yl)propionic acid Formula: C20H21NO3 MolecularWeight: 323.38564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CC3=CC=CC=C3)C=CC(=C2)OC)CCC(=O)O

Isomeric SMILES

CC1=C(C2=C(N1CC3=CC=CC=C3)C=CC(=C2)OC)CCC(=O)O

InChI

InChI=1S/C20H21NO3/c1-14-17(9-11-20(22)23)18-12-16(24-2)8-10-19(18)21(14)13-15-6-4-3-5-7-15/h3-8,10,12H,9,11,13H2,1-2H3,(H,22,23)