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

Systemtic Name: 4-[1-[(4-chlorophenyl)methyl]-5-methoxy-3-methyl-indol-2-yl]-3-methyl-butanoic acid Openeye Name: 4-[1-[(4-chlorophenyl)methyl]-5-methoxy-3-methyl-indol-2-yl]-3-methyl-butanoic acid CAS Name: 4-[1-[(4-chlorophenyl)methyl]-5-methoxy-3-methyl-2-indolyl]-3-methylbutanoic acid IUPAC Name: 4-[1-[(4-chlorophenyl)methyl]-5-methoxy-3-methylindol-2-yl]-3-methylbutanoic acid Traditional Name: 4-[1-(4-chlorobenzyl)-5-methoxy-3-methyl-indol-2-yl]-3-methyl-butyric acid Formula: C22H24ClNO3 MolecularWeight: 385.88386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=C1C=C(C=C2)OC)CC3=CC=C(C=C3)Cl)CC(C)CC(=O)O

Isomeric SMILES

CC1=C(N(C2=C1C=C(C=C2)OC)CC3=CC=C(C=C3)Cl)CC(C)CC(=O)O

InChI

InChI=1S/C22H24ClNO3/c1-14(11-22(25)26)10-21-15(2)19-12-18(27-3)8-9-20(19)24(21)13-16-4-6-17(23)7-5-16/h4-9,12,14H,10-11,13H2,1-3H3,(H,25,26)