3-[1-(4-chlorophenyl)carbonyl-2,5-dimethyl-indol-3-yl]propanoic acid

Systemtic Name: 3-[1-(4-chlorophenyl)carbonyl-2,5-dimethyl-indol-3-yl]propanoic acid Openeye Name: 3-[1-(4-chlorobenzoyl)-2,5-dimethyl-indol-3-yl]propanoic acid CAS Name: 3-[1-[(4-chlorophenyl)-oxomethyl]-2,5-dimethyl-3-indolyl]propanoic acid IUPAC Name: 3-[1-(4-chlorobenzoyl)-2,5-dimethylindol-3-yl]propanoic acid Traditional Name: 3-[1-(4-chlorobenzoyl)-2,5-dimethyl-indol-3-yl]propionic acid Formula: C20H18ClNO3 MolecularWeight: 355.81482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=C2CCC(=O)O)C)C(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=C2CCC(=O)O)C)C(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H18ClNO3/c1-12-3-9-18-17(11-12)16(8-10-19(23)24)13(2)22(18)20(25)14-4-6-15(21)7-5-14/h3-7,9,11H,8,10H2,1-2H3,(H,23,24)