(5-tert-butyl-5-oxidanyl-4H-pyrazol-1-yl)-(3-nitrophenyl)methanone

Systemtic Name: (5-tert-butyl-5-oxidanyl-4H-pyrazol-1-yl)-(3-nitrophenyl)methanone Openeye Name: (5-tert-butyl-5-hydroxy-4H-pyrazol-1-yl)-(3-nitrophenyl)methanone CAS Name: (5-tert-butyl-5-hydroxy-4H-pyrazol-1-yl)-(3-nitrophenyl)methanone IUPAC Name: (5-tert-butyl-5-hydroxy-4H-pyrazol-1-yl)-(3-nitrophenyl)methanone Traditional Name: (5-tert-butyl-5-hydroxy-2-pyrazolin-1-yl)-(3-nitrophenyl)methanone Formula: C14H17N3O4 MolecularWeight: 291.30248

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1(CC=NN1C(=O)C2=CC(=CC=C2)[N+](=O)[O-])O

Isomeric SMILES

CC(C)(C)C1(CC=NN1C(=O)C2=CC(=CC=C2)[N+](=O)[O-])O

InChI

InChI=1S/C14H17N3O4/c1-13(2,3)14(19)7-8-15-16(14)12(18)10-5-4-6-11(9-10)17(20)21/h4-6,8-9,19H,7H2,1-3H3