(3-ethyl-5-oxidanyl-5-phenyl-4H-pyrazol-1-yl)-(2-nitrophenyl)methanone

Systemtic Name: (3-ethyl-5-oxidanyl-5-phenyl-4H-pyrazol-1-yl)-(2-nitrophenyl)methanone Openeye Name: (3-ethyl-5-hydroxy-5-phenyl-4H-pyrazol-1-yl)-(2-nitrophenyl)methanone CAS Name: (3-ethyl-5-hydroxy-5-phenyl-4H-pyrazol-1-yl)-(2-nitrophenyl)methanone IUPAC Name: (3-ethyl-5-hydroxy-5-phenyl-4H-pyrazol-1-yl)-(2-nitrophenyl)methanone Traditional Name: (3-ethyl-5-hydroxy-5-phenyl-2-pyrazolin-1-yl)-(2-nitrophenyl)methanone Formula: C18H17N3O4 MolecularWeight: 339.34528

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(C1)(C2=CC=CC=C2)O)C(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CCC1=NN(C(C1)(C2=CC=CC=C2)O)C(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O4/c1-2-14-12-18(23,13-8-4-3-5-9-13)20(19-14)17(22)15-10-6-7-11-16(15)21(24)25/h3-11,23H,2,12H2,1H3