2-methylsulfonyl-3-(3-nitrophenyl)-5-phenyl-3,4-dihydropyrazole

Systemtic Name: 2-methylsulfonyl-3-(3-nitrophenyl)-5-phenyl-3,4-dihydropyrazole Openeye Name: 2-methylsulfonyl-3-(3-nitrophenyl)-5-phenyl-3,4-dihydropyrazole CAS Name: 2-methylsulfonyl-3-(3-nitrophenyl)-5-phenyl-3,4-dihydropyrazole IUPAC Name: 2-methylsulfonyl-3-(3-nitrophenyl)-5-phenyl-3,4-dihydropyrazole Traditional Name: 1-mesyl-5-(3-nitrophenyl)-3-phenyl-2-pyrazoline Formula: C16H15N3O4S MolecularWeight: 345.373

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1C(CC(=N1)C2=CC=CC=C2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)N1C(CC(=N1)C2=CC=CC=C2)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H15N3O4S/c1-24(22,23)18-16(13-8-5-9-14(10-13)19(20)21)11-15(17-18)12-6-3-2-4-7-12/h2-10,16H,11H2,1H3