4-[5-methoxy-2-methyl-1-(phenylmethyl)indol-3-yl]butanoic acid

Systemtic Name: 4-[5-methoxy-2-methyl-1-(phenylmethyl)indol-3-yl]butanoic acid Openeye Name: 4-(1-benzyl-5-methoxy-2-methyl-indol-3-yl)butanoic acid CAS Name: 4-[5-methoxy-2-methyl-1-(phenylmethyl)-3-indolyl]butanoic acid IUPAC Name: 4-(1-benzyl-5-methoxy-2-methylindol-3-yl)butanoic acid Traditional Name: 4-(1-benzyl-5-methoxy-2-methyl-indol-3-yl)butyric acid Formula: C21H23NO3 MolecularWeight: 337.41222

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23NO3/c1-15-18(9-6-10-21(23)24)19-13-17(25-2)11-12-20(19)22(15)14-16-7-4-3-5-8-16/h3-5,7-8,11-13H,6,9-10,14H2,1-2H3,(H,23,24)