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

Systemtic Name: N-[(E)-1-(3-nitrophenyl)ethylideneamino]-2-[4-(phenylmethyl)piperazin-1-yl]ethanamide Openeye Name: 2-(4-benzylpiperazin-1-yl)-N-[(E)-1-(3-nitrophenyl)ethylideneamino]acetamide CAS Name: N-[(E)-1-(3-nitrophenyl)ethylideneamino]-2-[4-(phenylmethyl)-1-piperazinyl]acetamide IUPAC Name: 2-(4-benzylpiperazin-1-yl)-N-[(E)-1-(3-nitrophenyl)ethylideneamino]acetamide Traditional Name: 2-(4-benzylpiperazino)-N-[(E)-1-(3-nitrophenyl)ethylideneamino]acetamide Formula: C21H25N5O3 MolecularWeight: 395.4549

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)CN1CCN(CC1)CC2=CC=CC=C2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C/C(=N\NC(=O)CN1CCN(CC1)CC2=CC=CC=C2)/C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H25N5O3/c1-17(19-8-5-9-20(14-19)26(28)29)22-23-21(27)16-25-12-10-24(11-13-25)15-18-6-3-2-4-7-18/h2-9,14H,10-13,15-16H2,1H3,(H,23,27)/b22-17+