4,5-bis[2-(3-nitrophenyl)-2-oxidanylidene-ethyl]-2-phenyl-1,6a-dihydropyrrolo[2,3-c]pyrazol-3-one

Systemtic Name: 4,5-bis[2-(3-nitrophenyl)-2-oxidanylidene-ethyl]-2-phenyl-1,6a-dihydropyrrolo[2,3-c]pyrazol-3-one Openeye Name: 4,5-bis[2-(3-nitrophenyl)-2-oxo-ethyl]-2-phenyl-1,6a-dihydropyrrolo[2,3-c]pyrazol-3-one CAS Name: 4,5-bis[2-(3-nitrophenyl)-2-oxoethyl]-2-phenyl-1,6a-dihydropyrrolo[2,3-c]pyrazol-3-one IUPAC Name: 4,5-bis[2-(3-nitrophenyl)-2-oxoethyl]-2-phenyl-1,6a-dihydropyrrolo[2,3-c]pyrazol-3-one Traditional Name: 4,5-bis[2-keto-2-(3-nitrophenyl)ethyl]-2-phenyl-1,6a-dihydropyrrolo[2,3-c]pyrazol-3-one Formula: C27H19N5O7 MolecularWeight: 525.46906

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C3=C(C(=NC3N2)CC(=O)C4=CC(=CC=C4)[N+](=O)[O-])CC(=O)C5=CC(=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C3=C(C(=NC3N2)CC(=O)C4=CC(=CC=C4)[N+](=O)[O-])CC(=O)C5=CC(=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C27H19N5O7/c33-23(16-6-4-10-19(12-16)31(36)37)14-21-22(15-24(34)17-7-5-11-20(13-17)32(38)39)28-26-25(21)27(35)30(29-26)18-8-2-1-3-9-18/h1-13,26,29H,14-15H2