4-(4-ethanoylpiperazin-1-yl)-3-nitro-N-(3-oxidanylpyridin-2-yl)benzamide

Systemtic Name: 4-(4-ethanoylpiperazin-1-yl)-3-nitro-N-(3-oxidanylpyridin-2-yl)benzamide Openeye Name: 4-(4-acetylpiperazin-1-yl)-N-(3-hydroxy-2-pyridyl)-3-nitro-benzamide CAS Name: 4-(4-acetyl-1-piperazinyl)-N-(3-hydroxy-2-pyridinyl)-3-nitrobenzamide IUPAC Name: 4-(4-acetylpiperazin-1-yl)-N-(3-hydroxypyridin-2-yl)-3-nitrobenzamide Traditional Name: 4-(4-acetylpiperazino)-N-(3-hydroxy-2-pyridyl)-3-nitro-benzamide Formula: C18H19N5O5 MolecularWeight: 385.37396

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=C(C=CC=N3)O)[N+](=O)[O-]

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=C(C=CC=N3)O)[N+](=O)[O-]

InChI

InChI=1S/C18H19N5O5/c1-12(24)21-7-9-22(10-8-21)14-5-4-13(11-15(14)23(27)28)18(26)20-17-16(25)3-2-6-19-17/h2-6,11,25H,7-10H2,1H3,(H,19,20,26)