(1-chloranyl-2-methyl-1-oxidanylidene-propan-2-yl) (E)-octadec-9-enoate

Systemtic Name: (1-chloranyl-2-methyl-1-oxidanylidene-propan-2-yl) (E)-octadec-9-enoate Openeye Name: (2-chloro-1,1-dimethyl-2-oxo-ethyl) (E)-octadec-9-enoate CAS Name: (E)-9-octadecenoic acid (1-chloro-2-methyl-1-oxopropan-2-yl) ester IUPAC Name: (1-chloro-2-methyl-1-oxopropan-2-yl) (E)-octadec-9-enoate Traditional Name: (E)-octadec-9-enoic acid (2-chloro-2-keto-1,1-dimethyl-ethyl) ester Formula: C22H39ClO3 MolecularWeight: 386.99626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)OC(C)(C)C(=O)Cl

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)OC(C)(C)C(=O)Cl

InChI

InChI=1S/C22H39ClO3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(24)26-22(2,3)21(23)25/h11-12H,4-10,13-19H2,1-3H3/b12-11+