(2R)-2-(benzotriazol-1-yl)-N'-[(3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]propanehydrazide

Systemtic Name: (2R)-2-(benzotriazol-1-yl)-N'-[(3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]propanehydrazide Openeye Name: (2R)-2-(benzotriazol-1-yl)-N'-[(3-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]propanehydrazide CAS Name: (2R)-2-(1-benzotriazolyl)-N'-[(3-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methyl]propanehydrazide IUPAC Name: (2R)-2-(benzotriazol-1-yl)-N'-[(3-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]propanehydrazide Traditional Name: (2R)-2-(benzotriazol-1-yl)-N'-[(6-keto-3-nitro-cyclohexa-2,4-dien-1-ylidene)methyl]propionohydrazide Formula: C16H14N6O4 MolecularWeight: 354.32016

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NNC=C1C=C(C=CC1=O)[N+](=O)[O-])N2C3=CC=CC=C3N=N2

Isomeric SMILES

C[C@H](C(=O)NNC=C1C=C(C=CC1=O)[N+](=O)[O-])N2C3=CC=CC=C3N=N2

InChI

InChI=1S/C16H14N6O4/c1-10(21-14-5-3-2-4-13(14)18-20-21)16(24)19-17-9-11-8-12(22(25)26)6-7-15(11)23/h2-10,17H,1H3,(H,19,24)/t10-/m1/s1