[2-(propan-2-ylsulfonylmethyl)phenyl] nitrate

Systemtic Name: [2-(propan-2-ylsulfonylmethyl)phenyl] nitrate Openeye Name: [2-(isopropylsulfonylmethyl)phenyl] nitrate CAS Name: nitric acid [2-(propan-2-ylsulfonylmethyl)phenyl] ester IUPAC Name: [2-(propan-2-ylsulfonylmethyl)phenyl] nitrate Traditional Name: nitric acid [2-(isopropylsulfonylmethyl)phenyl] ester Formula: C10H13NO5S MolecularWeight: 259.27892

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)CC1=CC=CC=C1O[N+](=O)[O-]

Isomeric SMILES

CC(C)S(=O)(=O)CC1=CC=CC=C1O[N+](=O)[O-]

InChI

InChI=1S/C10H13NO5S/c1-8(2)17(14,15)7-9-5-3-4-6-10(9)16-11(12)13/h3-6,8H,7H2,1-2H3