9-[3-(4-chlorophenyl)carbonyl-2-methyl-phenyl]nonanoic acid

Systemtic Name: 9-[3-(4-chlorophenyl)carbonyl-2-methyl-phenyl]nonanoic acid Openeye Name: 9-[3-(4-chlorobenzoyl)-2-methyl-phenyl]nonanoic acid CAS Name: 9-[3-[(4-chlorophenyl)-oxomethyl]-2-methylphenyl]nonanoic acid IUPAC Name: 9-[3-(4-chlorobenzoyl)-2-methylphenyl]nonanoic acid Traditional Name: 9-[3-(4-chlorobenzoyl)-2-methyl-phenyl]pelargonic acid Formula: C23H27ClO3 MolecularWeight: 386.91168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1CCCCCCCCC(=O)O)C(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC1=C(C=CC=C1CCCCCCCCC(=O)O)C(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C23H27ClO3/c1-17-18(9-6-4-2-3-5-7-12-22(25)26)10-8-11-21(17)23(27)19-13-15-20(24)16-14-19/h8,10-11,13-16H,2-7,9,12H2,1H3,(H,25,26)