(4-nitrophenyl) 3-oxidanylidene-4,5-diphenyl-pyrazolidine-1-carboxylate

Systemtic Name: (4-nitrophenyl) 3-oxidanylidene-4,5-diphenyl-pyrazolidine-1-carboxylate Openeye Name: (4-nitrophenyl) 3-oxo-4,5-diphenyl-pyrazolidine-1-carboxylate CAS Name: 3-oxo-4,5-diphenyl-1-pyrazolidinecarboxylic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) 3-oxo-4,5-diphenylpyrazolidine-1-carboxylate Traditional Name: 3-keto-4,5-diphenyl-pyrazolidine-1-carboxylic acid (4-nitrophenyl) ester Formula: C22H17N3O5 MolecularWeight: 403.38748

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2C(N(NC2=O)C(=O)OC3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2C(N(NC2=O)C(=O)OC3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C22H17N3O5/c26-21-19(15-7-3-1-4-8-15)20(16-9-5-2-6-10-16)24(23-21)22(27)30-18-13-11-17(12-14-18)25(28)29/h1-14,19-20H,(H,23,26)