ethyl 4-[3-(4-chlorophenyl)-3-oxidanylidene-propyl]piperazine-1-carboxylate dihydrochloride

Systemtic Name: ethyl 4-[3-(4-chlorophenyl)-3-oxidanylidene-propyl]piperazine-1-carboxylate dihydrochloride Openeye Name: ethyl 4-[3-(4-chlorophenyl)-3-oxo-propyl]piperazine-1-carboxylate dihydrochloride CAS Name: 4-[3-(4-chlorophenyl)-3-oxopropyl]-1-piperazinecarboxylic acid ethyl ester dihydrochloride IUPAC Name: ethyl 4-[3-(4-chlorophenyl)-3-oxopropyl]piperazine-1-carboxylate dihydrochloride Traditional Name: 4-[3-(4-chlorophenyl)-3-keto-propyl]piperazine-1-carboxylic acid ethyl ester dihydrochloride Formula: C16H23Cl3N2O3 MolecularWeight: 397.72442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)CCC(=O)C2=CC=C(C=C2)Cl.Cl.Cl

Isomeric SMILES

CCOC(=O)N1CCN(CC1)CCC(=O)C2=CC=C(C=C2)Cl.Cl.Cl

InChI

InChI=1S/C16H21ClN2O3.2ClH/c1-2-22-16(21)19-11-9-18(10-12-19)8-7-15(20)13-3-5-14(17)6-4-13;;/h3-6H,2,7-12H2,1H3;2*1H