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

Systemtic Name: [1-cyclopentyl-5-(4-methylsulfonylphenyl)pyrazol-3-yl]methyl nitrate Openeye Name: [1-cyclopentyl-5-(4-methylsulfonylphenyl)pyrazol-3-yl]methyl nitrate CAS Name: nitric acid [1-cyclopentyl-5-(4-methylsulfonylphenyl)-3-pyrazolyl]methyl ester IUPAC Name: [1-cyclopentyl-5-(4-methylsulfonylphenyl)pyrazol-3-yl]methyl nitrate Traditional Name: nitric acid [1-cyclopentyl-5-(4-mesylphenyl)pyrazol-3-yl]methyl ester Formula: C16H19N3O5S MolecularWeight: 365.40416

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=CC(=NN2C3CCCC3)CO[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=CC(=NN2C3CCCC3)CO[N+](=O)[O-]

InChI

InChI=1S/C16H19N3O5S/c1-25(22,23)15-8-6-12(7-9-15)16-10-13(11-24-19(20)21)17-18(16)14-4-2-3-5-14/h6-10,14H,2-5,11H2,1H3