3-nitro-N-oxidanyl-2-[4-(phenylmethyl)piperazin-1-yl]benzamide

Systemtic Name: 3-nitro-N-oxidanyl-2-[4-(phenylmethyl)piperazin-1-yl]benzamide Openeye Name: 2-(4-benzylpiperazin-1-yl)-3-nitro-benzenecarbohydroxamic acid CAS Name: N-hydroxy-3-nitro-2-[4-(phenylmethyl)-1-piperazinyl]benzamide IUPAC Name: 2-(4-benzylpiperazin-1-yl)-N-hydroxy-3-nitrobenzamide Traditional Name: 2-(4-benzylpiperazino)-3-nitro-benzenecarbohydroxamic acid Formula: C18H20N4O4 MolecularWeight: 356.3758

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C3=C(C=CC=C3[N+](=O)[O-])C(=O)NO

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C3=C(C=CC=C3[N+](=O)[O-])C(=O)NO

InChI

InChI=1S/C18H20N4O4/c23-18(19-24)15-7-4-8-16(22(25)26)17(15)21-11-9-20(10-12-21)13-14-5-2-1-3-6-14/h1-8,24H,9-13H2,(H,19,23)