N-[2-[[1-[(4-chlorophenyl)methyl]piperidin-4-yl]methylamino]-2-oxidanylidene-ethyl]-3-nitro-benzamide

Systemtic Name: N-[2-[[1-[(4-chlorophenyl)methyl]piperidin-4-yl]methylamino]-2-oxidanylidene-ethyl]-3-nitro-benzamide Openeye Name: N-[2-[[1-[(4-chlorophenyl)methyl]-4-piperidyl]methylamino]-2-oxo-ethyl]-3-nitro-benzamide CAS Name: N-[2-[[1-[(4-chlorophenyl)methyl]-4-piperidinyl]methylamino]-2-oxoethyl]-3-nitrobenzamide IUPAC Name: N-[2-[[1-[(4-chlorophenyl)methyl]piperidin-4-yl]methylamino]-2-oxoethyl]-3-nitrobenzamide Traditional Name: N-[2-[[1-(4-chlorobenzyl)-4-piperidyl]methylamino]-2-keto-ethyl]-3-nitro-benzamide Formula: C22H25ClN4O4 MolecularWeight: 444.9113

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CNC(=O)CNC(=O)C2=CC(=CC=C2)[N+](=O)[O-])CC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CN(CCC1CNC(=O)CNC(=O)C2=CC(=CC=C2)[N+](=O)[O-])CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H25ClN4O4/c23-19-6-4-17(5-7-19)15-26-10-8-16(9-11-26)13-24-21(28)14-25-22(29)18-2-1-3-20(12-18)27(30)31/h1-7,12,16H,8-11,13-15H2,(H,24,28)(H,25,29)