3-[1-[(4-chlorophenyl)methyl]-3,6-dimethyl-indol-2-yl]propanoic acid

Systemtic Name: 3-[1-[(4-chlorophenyl)methyl]-3,6-dimethyl-indol-2-yl]propanoic acid Openeye Name: 3-[1-[(4-chlorophenyl)methyl]-3,6-dimethyl-indol-2-yl]propanoic acid CAS Name: 3-[1-[(4-chlorophenyl)methyl]-3,6-dimethyl-2-indolyl]propanoic acid IUPAC Name: 3-[1-[(4-chlorophenyl)methyl]-3,6-dimethylindol-2-yl]propanoic acid Traditional Name: 3-[1-(4-chlorobenzyl)-3,6-dimethyl-indol-2-yl]propionic acid Formula: C20H20ClNO2 MolecularWeight: 341.8313

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=C(N2CC3=CC=C(C=C3)Cl)CCC(=O)O)C

Isomeric SMILES

CC1=CC2=C(C=C1)C(=C(N2CC3=CC=C(C=C3)Cl)CCC(=O)O)C

InChI

InChI=1S/C20H20ClNO2/c1-13-3-8-17-14(2)18(9-10-20(23)24)22(19(17)11-13)12-15-4-6-16(21)7-5-15/h3-8,11H,9-10,12H2,1-2H3,(H,23,24)