[3-ethyl-5-(4-methylphenyl)-5-oxidanyl-4H-pyrazol-1-yl]-(3-nitrophenyl)methanone

Systemtic Name: [3-ethyl-5-(4-methylphenyl)-5-oxidanyl-4H-pyrazol-1-yl]-(3-nitrophenyl)methanone Openeye Name: [3-ethyl-5-hydroxy-5-(p-tolyl)-4H-pyrazol-1-yl]-(3-nitrophenyl)methanone CAS Name: [3-ethyl-5-hydroxy-5-(4-methylphenyl)-4H-pyrazol-1-yl]-(3-nitrophenyl)methanone IUPAC Name: [3-ethyl-5-hydroxy-5-(4-methylphenyl)-4H-pyrazol-1-yl]-(3-nitrophenyl)methanone Traditional Name: [3-ethyl-5-hydroxy-5-(p-tolyl)-2-pyrazolin-1-yl]-(3-nitrophenyl)methanone Formula: C19H19N3O4 MolecularWeight: 353.37186

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19N3O4/c1-3-16-12-19(24,15-9-7-13(2)8-10-15)21(20-16)18(23)14-5-4-6-17(11-14)22(25)26/h4-11,24H,3,12H2,1-2H3