[3-chloranyl-1-(cyclohexylamino)-2-methyl-1-oxidanylidene-propan-2-yl] ethanoate

Systemtic Name: [3-chloranyl-1-(cyclohexylamino)-2-methyl-1-oxidanylidene-propan-2-yl] ethanoate Openeye Name: [1-(chloromethyl)-2-(cyclohexylamino)-1-methyl-2-oxo-ethyl] acetate CAS Name: acetic acid [3-chloro-1-(cyclohexylamino)-2-methyl-1-oxopropan-2-yl] ester IUPAC Name: [3-chloro-1-(cyclohexylamino)-2-methyl-1-oxopropan-2-yl] acetate Traditional Name: acetic acid [1-(chloromethyl)-2-(cyclohexylamino)-2-keto-1-methyl-ethyl] ester Formula: C12H20ClNO3 MolecularWeight: 261.7451

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C)(CCl)C(=O)NC1CCCCC1

Isomeric SMILES

CC(=O)OC(C)(CCl)C(=O)NC1CCCCC1

InChI

InChI=1S/C12H20ClNO3/c1-9(15)17-12(2,8-13)11(16)14-10-6-4-3-5-7-10/h10H,3-8H2,1-2H3,(H,14,16)