[1-cyclohexyl-5-(4-methylsulfonylphenyl)pyrazol-3-yl]methyl nitrate

Systemtic Name: [1-cyclohexyl-5-(4-methylsulfonylphenyl)pyrazol-3-yl]methyl nitrate Openeye Name: [1-cyclohexyl-5-(4-methylsulfonylphenyl)pyrazol-3-yl]methyl nitrate CAS Name: nitric acid [1-cyclohexyl-5-(4-methylsulfonylphenyl)-3-pyrazolyl]methyl ester IUPAC Name: [1-cyclohexyl-5-(4-methylsulfonylphenyl)pyrazol-3-yl]methyl nitrate Traditional Name: nitric acid [1-cyclohexyl-5-(4-mesylphenyl)pyrazol-3-yl]methyl ester Formula: C17H21N3O5S MolecularWeight: 379.43074

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=CC(=NN2C3CCCCC3)CO[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=CC(=NN2C3CCCCC3)CO[N+](=O)[O-]

InChI

InChI=1S/C17H21N3O5S/c1-26(23,24)16-9-7-13(8-10-16)17-11-14(12-25-20(21)22)18-19(17)15-5-3-2-4-6-15/h7-11,15H,2-6,12H2,1H3