[2,2-dimethyl-3-(2-nitrophenyl)-3-oxidanyl-propyl] methanesulfonate

Systemtic Name: [2,2-dimethyl-3-(2-nitrophenyl)-3-oxidanyl-propyl] methanesulfonate Openeye Name: [3-hydroxy-2,2-dimethyl-3-(2-nitrophenyl)propyl] methanesulfonate CAS Name: methanesulfonic acid [3-hydroxy-2,2-dimethyl-3-(2-nitrophenyl)propyl] ester IUPAC Name: [3-hydroxy-2,2-dimethyl-3-(2-nitrophenyl)propyl] methanesulfonate Traditional Name: methanesulfonic acid [3-hydroxy-2,2-dimethyl-3-(2-nitrophenyl)propyl] ester Formula: C12H17NO6S MolecularWeight: 303.33148

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(COS(=O)(=O)C)C(C1=CC=CC=C1[N+](=O)[O-])O

Isomeric SMILES

CC(C)(COS(=O)(=O)C)C(C1=CC=CC=C1[N+](=O)[O-])O

InChI

InChI=1S/C12H17NO6S/c1-12(2,8-19-20(3,17)18)11(14)9-6-4-5-7-10(9)13(15)16/h4-7,11,14H,8H2,1-3H3