2-[4-[(4-methylphenyl)methyl]piperazin-1-yl]-N-[(3-nitrophenyl)methylideneamino]ethanamide

Systemtic Name: 2-[4-[(4-methylphenyl)methyl]piperazin-1-yl]-N-[(3-nitrophenyl)methylideneamino]ethanamide Openeye Name: N-[(3-nitrophenyl)methyleneamino]-2-[4-(p-tolylmethyl)piperazin-1-yl]acetamide CAS Name: 2-[4-[(4-methylphenyl)methyl]-1-piperazinyl]-N-[(3-nitrophenyl)methylideneamino]acetamide IUPAC Name: 2-[4-[(4-methylphenyl)methyl]piperazin-1-yl]-N-[(3-nitrophenyl)methylideneamino]acetamide Traditional Name: 2-[4-(4-methylbenzyl)piperazino]-N-[(3-nitrobenzylidene)amino]acetamide Formula: C21H25N5O3 MolecularWeight: 395.4549

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CCN(CC2)CC(=O)NN=CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)CN2CCN(CC2)CC(=O)NN=CC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H25N5O3/c1-17-5-7-18(8-6-17)15-24-9-11-25(12-10-24)16-21(27)23-22-14-19-3-2-4-20(13-19)26(28)29/h2-8,13-14H,9-12,15-16H2,1H3,(H,23,27)