N-[(E)-(3-nitrophenyl)methylideneamino]-2-[4-(phenylmethyl)piperazin-1-yl]ethanamide

Systemtic Name: N-[(E)-(3-nitrophenyl)methylideneamino]-2-[4-(phenylmethyl)piperazin-1-yl]ethanamide Openeye Name: 2-(4-benzylpiperazin-1-yl)-N-[(E)-(3-nitrophenyl)methyleneamino]acetamide CAS Name: N-[(E)-(3-nitrophenyl)methylideneamino]-2-[4-(phenylmethyl)-1-piperazinyl]acetamide IUPAC Name: 2-(4-benzylpiperazin-1-yl)-N-[(E)-(3-nitrophenyl)methylideneamino]acetamide Traditional Name: 2-(4-benzylpiperazino)-N-[(E)-(3-nitrobenzylidene)amino]acetamide Formula: C20H23N5O3 MolecularWeight: 381.42832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)CC(=O)NN=CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)CC(=O)N/N=C/C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H23N5O3/c26-20(22-21-14-18-7-4-8-19(13-18)25(27)28)16-24-11-9-23(10-12-24)15-17-5-2-1-3-6-17/h1-8,13-14H,9-12,15-16H2,(H,22,26)/b21-14+