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

Systemtic Name: 3-[1-[(4-chlorophenyl)methyl]-5-methoxy-2-methyl-indol-3-yl]-2-methyl-propanoic acid Openeye Name: 3-[1-[(4-chlorophenyl)methyl]-5-methoxy-2-methyl-indol-3-yl]-2-methyl-propanoic acid CAS Name: 3-[1-[(4-chlorophenyl)methyl]-5-methoxy-2-methyl-3-indolyl]-2-methylpropanoic acid IUPAC Name: 3-[1-[(4-chlorophenyl)methyl]-5-methoxy-2-methylindol-3-yl]-2-methylpropanoic acid Traditional Name: 3-[1-(4-chlorobenzyl)-5-methoxy-2-methyl-indol-3-yl]-2-methyl-propionic acid Formula: C21H22ClNO3 MolecularWeight: 371.85728

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22ClNO3/c1-13(21(24)25)10-18-14(2)23(12-15-4-6-16(22)7-5-15)20-9-8-17(26-3)11-19(18)20/h4-9,11,13H,10,12H2,1-3H3,(H,24,25)