nitro 4-[3,5-bis(oxidanylidene)-1,2-diphenyl-pyrazolidin-4-yl]butanoate

Systemtic Name: nitro 4-[3,5-bis(oxidanylidene)-1,2-diphenyl-pyrazolidin-4-yl]butanoate Openeye Name: nitro 4-(3,5-dioxo-1,2-diphenyl-pyrazolidin-4-yl)butanoate CAS Name: 4-(3,5-dioxo-1,2-diphenyl-4-pyrazolidinyl)butanoic acid nitro ester IUPAC Name: nitro 4-(3,5-dioxo-1,2-diphenylpyrazolidin-4-yl)butanoate Traditional Name: 4-(3,5-diketo-1,2-diphenyl-pyrazolidin-4-yl)butyric acid nitro ester Formula: C19H17N3O6 MolecularWeight: 383.35478

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C(C(=O)N2C3=CC=CC=C3)CCCC(=O)O[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C(C(=O)N2C3=CC=CC=C3)CCCC(=O)O[N+](=O)[O-]

InChI

InChI=1S/C19H17N3O6/c23-17(28-22(26)27)13-7-12-16-18(24)20(14-8-3-1-4-9-14)21(19(16)25)15-10-5-2-6-11-15/h1-6,8-11,16H,7,12-13H2