(2-methylcyclohexyl) 2-nitrobenzenesulfonate

Systemtic Name: (2-methylcyclohexyl) 2-nitrobenzenesulfonate Openeye Name: (2-methylcyclohexyl) 2-nitrobenzenesulfonate CAS Name: 2-nitrobenzenesulfonic acid (2-methylcyclohexyl) ester IUPAC Name: (2-methylcyclohexyl) 2-nitrobenzenesulfonate Traditional Name: 2-nitrobenzenesulfonic acid (2-methylcyclohexyl) ester Formula: C13H17NO5S MolecularWeight: 299.34278

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1OS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC1CCCCC1OS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C13H17NO5S/c1-10-6-2-4-8-12(10)19-20(17,18)13-9-5-3-7-11(13)14(15)16/h3,5,7,9-10,12H,2,4,6,8H2,1H3