[2-[[3,5-bis(oxidanylidene)-1-phenyl-pyrazolidin-4-ylidene]methyl]-4-nitro-phenyl] 4-nitrobenzoate

Systemtic Name: [2-[[3,5-bis(oxidanylidene)-1-phenyl-pyrazolidin-4-ylidene]methyl]-4-nitro-phenyl] 4-nitrobenzoate Openeye Name: [2-[(3,5-dioxo-1-phenyl-pyrazolidin-4-ylidene)methyl]-4-nitro-phenyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [2-[(3,5-dioxo-1-phenyl-4-pyrazolidinylidene)methyl]-4-nitrophenyl] ester IUPAC Name: [2-[(3,5-dioxo-1-phenylpyrazolidin-4-ylidene)methyl]-4-nitrophenyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [2-[(3,5-diketo-1-phenyl-pyrazolidin-4-ylidene)methyl]-4-nitro-phenyl] ester Formula: C23H14N4O8 MolecularWeight: 474.37926

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C(=CC3=C(C=CC(=C3)[N+](=O)[O-])OC(=O)C4=CC=C(C=C4)[N+](=O)[O-])C(=O)N2

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C(=CC3=C(C=CC(=C3)[N+](=O)[O-])OC(=O)C4=CC=C(C=C4)[N+](=O)[O-])C(=O)N2

InChI

InChI=1S/C23H14N4O8/c28-21-19(22(29)25(24-21)16-4-2-1-3-5-16)13-15-12-18(27(33)34)10-11-20(15)35-23(30)14-6-8-17(9-7-14)26(31)32/h1-13H,(H,24,28)