4-(azepan-1-yl)-3-nitro-N'-[2-(2-oxidanylidenepyridin-1-yl)ethanoyl]benzohydrazide

Systemtic Name: 4-(azepan-1-yl)-3-nitro-N'-[2-(2-oxidanylidenepyridin-1-yl)ethanoyl]benzohydrazide Openeye Name: 4-(azepan-1-yl)-3-nitro-N'-[2-(2-oxo-1-pyridyl)acetyl]benzohydrazide CAS Name: 4-(1-azepanyl)-3-nitro-N'-[1-oxo-2-(2-oxo-1-pyridinyl)ethyl]benzohydrazide IUPAC Name: 4-(azepan-1-yl)-3-nitro-N'-[2-(2-oxopyridin-1-yl)acetyl]benzohydrazide Traditional Name: 4-(azepan-1-yl)-N'-[2-(2-keto-1-pyridyl)acetyl]-3-nitro-benzohydrazide Formula: C20H23N5O5 MolecularWeight: 413.42712

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(C=C(C=C2)C(=O)NNC(=O)CN3C=CC=CC3=O)[N+](=O)[O-]

Isomeric SMILES

C1CCCN(CC1)C2=C(C=C(C=C2)C(=O)NNC(=O)CN3C=CC=CC3=O)[N+](=O)[O-]

InChI

InChI=1S/C20H23N5O5/c26-18(14-24-12-6-3-7-19(24)27)21-22-20(28)15-8-9-16(17(13-15)25(29)30)23-10-4-1-2-5-11-23/h3,6-9,12-13H,1-2,4-5,10-11,14H2,(H,21,26)(H,22,28)