3-[2-[(3-chloranyl-4-methoxy-phenyl)methylamino]-2-oxidanylidene-ethyl]-N-(4-methoxyphenyl)piperazine-1-carboxamide

Systemtic Name: 3-[2-[(3-chloranyl-4-methoxy-phenyl)methylamino]-2-oxidanylidene-ethyl]-N-(4-methoxyphenyl)piperazine-1-carboxamide Openeye Name: 3-[2-[(3-chloro-4-methoxy-phenyl)methylamino]-2-oxo-ethyl]-N-(4-methoxyphenyl)piperazine-1-carboxamide CAS Name: 3-[2-[(3-chloro-4-methoxyphenyl)methylamino]-2-oxoethyl]-N-(4-methoxyphenyl)-1-piperazinecarboxamide IUPAC Name: 3-[2-[(3-chloro-4-methoxyphenyl)methylamino]-2-oxoethyl]-N-(4-methoxyphenyl)piperazine-1-carboxamide Traditional Name: 3-[2-[(3-chloro-4-methoxy-benzyl)amino]-2-keto-ethyl]-N-(4-methoxyphenyl)piperazine-1-carboxamide Formula: C22H27ClN4O4 MolecularWeight: 446.92718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)N2CCNC(C2)CC(=O)NCC3=CC(=C(C=C3)OC)Cl

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)N2CCNC(C2)CC(=O)NCC3=CC(=C(C=C3)OC)Cl

InChI

InChI=1S/C22H27ClN4O4/c1-30-18-6-4-16(5-7-18)26-22(29)27-10-9-24-17(14-27)12-21(28)25-13-15-3-8-20(31-2)19(23)11-15/h3-8,11,17,24H,9-10,12-14H2,1-2H3,(H,25,28)(H,26,29)