(3-methyl-5-oxidanyl-5-pyridin-3-yl-4H-pyrazol-1-yl)-(4-nitrophenyl)methanone

Systemtic Name: (3-methyl-5-oxidanyl-5-pyridin-3-yl-4H-pyrazol-1-yl)-(4-nitrophenyl)methanone Openeye Name: [5-hydroxy-3-methyl-5-(3-pyridyl)-4H-pyrazol-1-yl]-(4-nitrophenyl)methanone CAS Name: [5-hydroxy-3-methyl-5-(3-pyridinyl)-4H-pyrazol-1-yl]-(4-nitrophenyl)methanone IUPAC Name: (5-hydroxy-3-methyl-5-pyridin-3-yl-4H-pyrazol-1-yl)-(4-nitrophenyl)methanone Traditional Name: [5-hydroxy-3-methyl-5-(3-pyridyl)-2-pyrazolin-1-yl]-(4-nitrophenyl)methanone Formula: C16H14N4O4 MolecularWeight: 326.30676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(C1)(C2=CN=CC=C2)O)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=NN(C(C1)(C2=CN=CC=C2)O)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H14N4O4/c1-11-9-16(22,13-3-2-8-17-10-13)19(18-11)15(21)12-4-6-14(7-5-12)20(23)24/h2-8,10,22H,9H2,1H3