N-(7-nitro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-6-oxidanylidene-1-phenyl-4,5-dihydropyridazine-3-carboxamide

Systemtic Name: N-(7-nitro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-6-oxidanylidene-1-phenyl-4,5-dihydropyridazine-3-carboxamide Openeye Name: N-(7-nitro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-6-oxo-1-phenyl-4,5-dihydropyridazine-3-carboxamide CAS Name: N-(7-nitro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-6-oxo-1-phenyl-4,5-dihydropyridazine-3-carboxamide IUPAC Name: N-(7-nitro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-6-oxo-1-phenyl-4,5-dihydropyridazine-3-carboxamide Traditional Name: 6-keto-N-(7-nitro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-1-phenyl-4,5-dihydropyridazine-3-carboxamide Formula: C20H18N4O6 MolecularWeight: 410.38012

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C(=C2)NC(=O)C3=NN(C(=O)CC3)C4=CC=CC=C4)[N+](=O)[O-])OC1

Isomeric SMILES

C1COC2=C(C=C(C(=C2)NC(=O)C3=NN(C(=O)CC3)C4=CC=CC=C4)[N+](=O)[O-])OC1

InChI

InChI=1S/C20H18N4O6/c25-19-8-7-14(22-23(19)13-5-2-1-3-6-13)20(26)21-15-11-17-18(12-16(15)24(27)28)30-10-4-9-29-17/h1-3,5-6,11-12H,4,7-10H2,(H,21,26)