4-(4-ethanoylpiperazin-1-yl)-3-nitro-N-(1H-pyrazol-4-yl)benzamide

Systemtic Name: 4-(4-ethanoylpiperazin-1-yl)-3-nitro-N-(1H-pyrazol-4-yl)benzamide Openeye Name: 4-(4-acetylpiperazin-1-yl)-3-nitro-N-(1H-pyrazol-4-yl)benzamide CAS Name: 4-(4-acetyl-1-piperazinyl)-3-nitro-N-(1H-pyrazol-4-yl)benzamide IUPAC Name: 4-(4-acetylpiperazin-1-yl)-3-nitro-N-(1H-pyrazol-4-yl)benzamide Traditional Name: 4-(4-acetylpiperazino)-3-nitro-N-(1H-pyrazol-4-yl)benzamide Formula: C16H18N6O4 MolecularWeight: 358.35192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CNN=C3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CNN=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H18N6O4/c1-11(23)20-4-6-21(7-5-20)14-3-2-12(8-15(14)22(25)26)16(24)19-13-9-17-18-10-13/h2-3,8-10H,4-7H2,1H3,(H,17,18)(H,19,24)