methyl 3-[2-[2-(3-chloranyl-4-methoxy-phenyl)ethylamino]-2-oxidanylidene-ethyl]piperazine-1-carboxylate

Systemtic Name: methyl 3-[2-[2-(3-chloranyl-4-methoxy-phenyl)ethylamino]-2-oxidanylidene-ethyl]piperazine-1-carboxylate Openeye Name: methyl 3-[2-[2-(3-chloro-4-methoxy-phenyl)ethylamino]-2-oxo-ethyl]piperazine-1-carboxylate CAS Name: 3-[2-[2-(3-chloro-4-methoxyphenyl)ethylamino]-2-oxoethyl]-1-piperazinecarboxylic acid methyl ester IUPAC Name: methyl 3-[2-[2-(3-chloro-4-methoxyphenyl)ethylamino]-2-oxoethyl]piperazine-1-carboxylate Traditional Name: 3-[2-[2-(3-chloro-4-methoxy-phenyl)ethylamino]-2-keto-ethyl]piperazine-1-carboxylic acid methyl ester Formula: C17H24ClN3O4 MolecularWeight: 369.84316

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)CC2CN(CCN2)C(=O)OC)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)CC2CN(CCN2)C(=O)OC)Cl

InChI

InChI=1S/C17H24ClN3O4/c1-24-15-4-3-12(9-14(15)18)5-6-20-16(22)10-13-11-21(8-7-19-13)17(23)25-2/h3-4,9,13,19H,5-8,10-11H2,1-2H3,(H,20,22)