4-[(Z)-N'-nitrocarbamimidoyl]-N-phenyl-piperazine-1-carboxamide

Systemtic Name: 4-[(Z)-N'-nitrocarbamimidoyl]-N-phenyl-piperazine-1-carboxamide Openeye Name: 4-[(Z)-N'-nitrocarbamimidoyl]-N-phenyl-piperazine-1-carboxamide CAS Name: 4-[(Z)-amino(nitroimino)methyl]-N-phenyl-1-piperazinecarboxamide IUPAC Name: 4-[(Z)-N'-nitrocarbamimidoyl]-N-phenylpiperazine-1-carboxamide Traditional Name: 4-[(Z)-N'-nitroamidino]-N-phenyl-piperazine-1-carboxamide Formula: C12H16N6O3 MolecularWeight: 292.29384

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=N[N+](=O)[O-])N)C(=O)NC2=CC=CC=C2

Isomeric SMILES

C1CN(CCN1/C(=N\[N+](=O)[O-])/N)C(=O)NC2=CC=CC=C2

InChI

InChI=1S/C12H16N6O3/c13-11(15-18(20)21)16-6-8-17(9-7-16)12(19)14-10-4-2-1-3-5-10/h1-5H,6-9H2,(H2,13,15)(H,14,19)