[(5S)-3-methyl-5-(4-nitrophenyl)-5-oxidanyl-4H-pyrazol-1-yl]-(4-nitrophenyl)methanone

Systemtic Name: [(5S)-3-methyl-5-(4-nitrophenyl)-5-oxidanyl-4H-pyrazol-1-yl]-(4-nitrophenyl)methanone Openeye Name: [(5S)-5-hydroxy-3-methyl-5-(4-nitrophenyl)-4H-pyrazol-1-yl]-(4-nitrophenyl)methanone CAS Name: [(5S)-5-hydroxy-3-methyl-5-(4-nitrophenyl)-4H-pyrazol-1-yl]-(4-nitrophenyl)methanone IUPAC Name: [(5S)-5-hydroxy-3-methyl-5-(4-nitrophenyl)-4H-pyrazol-1-yl]-(4-nitrophenyl)methanone Traditional Name: [(5S)-5-hydroxy-3-methyl-5-(4-nitrophenyl)-2-pyrazolin-1-yl]-(4-nitrophenyl)methanone Formula: C17H14N4O6 MolecularWeight: 370.31626

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H14N4O6/c1-11-10-17(23,13-4-8-15(9-5-13)21(26)27)19(18-11)16(22)12-2-6-14(7-3-12)20(24)25/h2-9,23H,10H2,1H3/t17-/m0/s1