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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(N(C2=CC=C1)CC3=CC=C(C=C3)Cl)CCC(=O)O)C

Isomeric SMILES

CC1=C2C(=C(N(C2=CC=C1)CC3=CC=C(C=C3)Cl)CCC(=O)O)C

InChI

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