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

Systemtic Name: 3-[2-[(4-chlorophenyl)methylamino]-2-oxidanylidene-ethyl]-N-(4-methoxyphenyl)piperazine-1-carboxamide Openeye Name: 3-[2-[(4-chlorophenyl)methylamino]-2-oxo-ethyl]-N-(4-methoxyphenyl)piperazine-1-carboxamide CAS Name: 3-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]-N-(4-methoxyphenyl)-1-piperazinecarboxamide IUPAC Name: 3-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]-N-(4-methoxyphenyl)piperazine-1-carboxamide Traditional Name: 3-[2-[(4-chlorobenzyl)amino]-2-keto-ethyl]-N-(4-methoxyphenyl)piperazine-1-carboxamide Formula: C21H25ClN4O3 MolecularWeight: 416.9012

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25ClN4O3/c1-29-19-8-6-17(7-9-19)25-21(28)26-11-10-23-18(14-26)12-20(27)24-13-15-2-4-16(22)5-3-15/h2-9,18,23H,10-14H2,1H3,(H,24,27)(H,25,28)