N'-[(3-nitro-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]-4-pyrrolidin-1-yl-benzohydrazide

Systemtic Name: N'-[(3-nitro-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]-4-pyrrolidin-1-yl-benzohydrazide Openeye Name: N'-[(3-nitro-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]-4-pyrrolidin-1-yl-benzohydrazide CAS Name: N'-[(3-nitro-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]-4-(1-pyrrolidinyl)benzohydrazide IUPAC Name: N'-[(3-nitro-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-4-pyrrolidin-1-ylbenzohydrazide Traditional Name: N'-[(4-keto-3-nitro-cyclohexa-2,5-dien-1-ylidene)methyl]-4-pyrrolidino-benzohydrazide Formula: C18H18N4O4 MolecularWeight: 354.35992

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC=C(C=C2)C(=O)NNC=C3C=CC(=O)C(=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=CC=C(C=C2)C(=O)NNC=C3C=CC(=O)C(=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H18N4O4/c23-17-8-3-13(11-16(17)22(25)26)12-19-20-18(24)14-4-6-15(7-5-14)21-9-1-2-10-21/h3-8,11-12,19H,1-2,9-10H2,(H,20,24)