hexyl 3-(2-chloranyl-6-methyl-phenyl)-3-oxidanylidene-2-phenyl-propanoate

Systemtic Name: hexyl 3-(2-chloranyl-6-methyl-phenyl)-3-oxidanylidene-2-phenyl-propanoate Openeye Name: hexyl 3-(2-chloro-6-methyl-phenyl)-3-oxo-2-phenyl-propanoate CAS Name: 3-(2-chloro-6-methylphenyl)-3-oxo-2-phenylpropanoic acid hexyl ester IUPAC Name: hexyl 3-(2-chloro-6-methylphenyl)-3-oxo-2-phenylpropanoate Traditional Name: 3-(2-chloro-6-methyl-phenyl)-3-keto-2-phenyl-propionic acid hexyl ester Formula: C22H25ClO3 MolecularWeight: 372.8851

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C(C1=CC=CC=C1)C(=O)C2=C(C=CC=C2Cl)C

Isomeric SMILES

CCCCCCOC(=O)C(C1=CC=CC=C1)C(=O)C2=C(C=CC=C2Cl)C

InChI

InChI=1S/C22H25ClO3/c1-3-4-5-9-15-26-22(25)20(17-12-7-6-8-13-17)21(24)19-16(2)11-10-14-18(19)23/h6-8,10-14,20H,3-5,9,15H2,1-2H3