(3,5-dimethyl-4-morpholin-4-ylsulfonyl-pyrazol-1-yl)-(3-nitrophenyl)methanone

Systemtic Name: (3,5-dimethyl-4-morpholin-4-ylsulfonyl-pyrazol-1-yl)-(3-nitrophenyl)methanone Openeye Name: (3,5-dimethyl-4-morpholinosulfonyl-pyrazol-1-yl)-(3-nitrophenyl)methanone CAS Name: [3,5-dimethyl-4-(4-morpholinylsulfonyl)-1-pyrazolyl]-(3-nitrophenyl)methanone IUPAC Name: (3,5-dimethyl-4-morpholin-4-ylsulfonylpyrazol-1-yl)-(3-nitrophenyl)methanone Traditional Name: (3,5-dimethyl-4-morpholinosulfonyl-pyrazol-1-yl)-(3-nitrophenyl)methanone Formula: C16H18N4O6S MolecularWeight: 394.40232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(=O)C2=CC(=CC=C2)[N+](=O)[O-])C)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=C(C(=NN1C(=O)C2=CC(=CC=C2)[N+](=O)[O-])C)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C16H18N4O6S/c1-11-15(27(24,25)18-6-8-26-9-7-18)12(2)19(17-11)16(21)13-4-3-5-14(10-13)20(22)23/h3-5,10H,6-9H2,1-2H3