(3S)-N'-[(3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]-2-oxidanylidene-piperidine-3-carbohydrazide

Systemtic Name: (3S)-N'-[(3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]-2-oxidanylidene-piperidine-3-carbohydrazide Openeye Name: (3S)-N'-[(3-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]-2-oxo-piperidine-3-carbohydrazide CAS Name: (3S)-N'-[(3-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methyl]-2-oxo-3-piperidinecarbohydrazide IUPAC Name: (3S)-N'-[(3-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]-2-oxopiperidine-3-carbohydrazide Traditional Name: (3S)-2-keto-N'-[(6-keto-3-nitro-cyclohexa-2,4-dien-1-ylidene)methyl]nipecotohydrazide Formula: C13H14N4O5 MolecularWeight: 306.27406

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(=O)NC1)C(=O)NNC=C2C=C(C=CC2=O)[N+](=O)[O-]

Isomeric SMILES

C1C[C@@H](C(=O)NC1)C(=O)NNC=C2C=C(C=CC2=O)[N+](=O)[O-]

InChI

InChI=1S/C13H14N4O5/c18-11-4-3-9(17(21)22)6-8(11)7-15-16-13(20)10-2-1-5-14-12(10)19/h3-4,6-7,10,15H,1-2,5H2,(H,14,19)(H,16,20)/t10-/m0/s1