(1-chloranyl-2-methyl-1-oxidanylidene-propan-2-yl) octadecanoate

Systemtic Name: (1-chloranyl-2-methyl-1-oxidanylidene-propan-2-yl) octadecanoate Openeye Name: (2-chloro-1,1-dimethyl-2-oxo-ethyl) octadecanoate CAS Name: octadecanoic acid (1-chloro-2-methyl-1-oxopropan-2-yl) ester IUPAC Name: (1-chloro-2-methyl-1-oxopropan-2-yl) octadecanoate Traditional Name: stearic acid (2-chloro-2-keto-1,1-dimethyl-ethyl) ester Formula: C22H41ClO3 MolecularWeight: 389.01214

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OC(C)(C)C(=O)Cl

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OC(C)(C)C(=O)Cl

InChI

InChI=1S/C22H41ClO3/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/h4-19H2,1-3H3