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

Systemtic Name: [4-[[3,5-bis(oxidanylidene)-1-phenyl-pyrazolidin-4-ylidene]methyl]-2-nitro-phenyl] ethanoate Openeye Name: [4-[(3,5-dioxo-1-phenyl-pyrazolidin-4-ylidene)methyl]-2-nitro-phenyl] acetate CAS Name: acetic acid [4-[(3,5-dioxo-1-phenyl-4-pyrazolidinylidene)methyl]-2-nitrophenyl] ester IUPAC Name: [4-[(3,5-dioxo-1-phenylpyrazolidin-4-ylidene)methyl]-2-nitrophenyl] acetate Traditional Name: acetic acid [4-[(3,5-diketo-1-phenyl-pyrazolidin-4-ylidene)methyl]-2-nitro-phenyl] ester Formula: C18H13N3O6 MolecularWeight: 367.31232

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1)C=C2C(=O)NN(C2=O)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1)C=C2C(=O)NN(C2=O)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H13N3O6/c1-11(22)27-16-8-7-12(10-15(16)21(25)26)9-14-17(23)19-20(18(14)24)13-5-3-2-4-6-13/h2-10H,1H3,(H,19,23)