N-[(2S)-butan-2-yl]-2-[2-[(3-nitro-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]hydrazinyl]-2-oxidanylidene-ethanamide

Systemtic Name: N-[(2S)-butan-2-yl]-2-[2-[(3-nitro-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]hydrazinyl]-2-oxidanylidene-ethanamide Openeye Name: N-[(1S)-1-methylpropyl]-2-[2-[(3-nitro-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]hydrazino]-2-oxo-acetamide CAS Name: N-[(2S)-butan-2-yl]-2-[(3-nitro-4-oxo-1-cyclohexa-2,5-dienylidene)methylhydrazo]-2-oxoacetamide IUPAC Name: N-[(2S)-butan-2-yl]-2-[2-[(3-nitro-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]hydrazinyl]-2-oxoacetamide Traditional Name: 2-keto-2-[N'-[(4-keto-3-nitro-cyclohexa-2,5-dien-1-ylidene)methyl]hydrazino]-N-[(1S)-1-methylpropyl]acetamide Formula: C13H16N4O5 MolecularWeight: 308.28994

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C(=O)NNC=C1C=CC(=O)C(=C1)[N+](=O)[O-]

Isomeric SMILES

CC[C@H](C)NC(=O)C(=O)NNC=C1C=CC(=O)C(=C1)[N+](=O)[O-]

InChI

InChI=1S/C13H16N4O5/c1-3-8(2)15-12(19)13(20)16-14-7-9-4-5-11(18)10(6-9)17(21)22/h4-8,14H,3H2,1-2H3,(H,15,19)(H,16,20)/t8-/m0/s1