3-[1-(4-chlorophenyl)-1-oxidanylidene-5-phenyl-pentan-3-yl]benzoic acid

Systemtic Name: 3-[1-(4-chlorophenyl)-1-oxidanylidene-5-phenyl-pentan-3-yl]benzoic acid Openeye Name: 3-[3-(4-chlorophenyl)-3-oxo-1-phenethyl-propyl]benzoic acid CAS Name: 3-[1-(4-chlorophenyl)-1-oxo-5-phenylpentan-3-yl]benzoic acid IUPAC Name: 3-[1-(4-chlorophenyl)-1-oxo-5-phenylpentan-3-yl]benzoic acid Traditional Name: 3-[3-(4-chlorophenyl)-3-keto-1-phenethyl-propyl]benzoic acid Formula: C24H21ClO3 MolecularWeight: 392.87474

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(CC(=O)C2=CC=C(C=C2)Cl)C3=CC=CC(=C3)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCC(CC(=O)C2=CC=C(C=C2)Cl)C3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C24H21ClO3/c25-22-13-11-18(12-14-22)23(26)16-20(10-9-17-5-2-1-3-6-17)19-7-4-8-21(15-19)24(27)28/h1-8,11-15,20H,9-10,16H2,(H,27,28)