ethyl 2-(2-chlorophenyl)carbonyl-5-oxidanylidene-dodecanoate

Systemtic Name: ethyl 2-(2-chlorophenyl)carbonyl-5-oxidanylidene-dodecanoate Openeye Name: ethyl 2-(2-chlorobenzoyl)-5-oxo-dodecanoate CAS Name: 2-[(2-chlorophenyl)-oxomethyl]-5-oxododecanoic acid ethyl ester IUPAC Name: ethyl 2-(2-chlorobenzoyl)-5-oxododecanoate Traditional Name: 2-(2-chlorobenzoyl)-5-keto-lauric acid ethyl ester Formula: C21H29ClO4 MolecularWeight: 380.90556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)CCC(C(=O)C1=CC=CC=C1Cl)C(=O)OCC

Isomeric SMILES

CCCCCCCC(=O)CCC(C(=O)C1=CC=CC=C1Cl)C(=O)OCC

InChI

InChI=1S/C21H29ClO4/c1-3-5-6-7-8-11-16(23)14-15-18(21(25)26-4-2)20(24)17-12-9-10-13-19(17)22/h9-10,12-13,18H,3-8,11,14-15H2,1-2H3