cyclohexylmethyl 4-nitrobenzenesulfonate

Systemtic Name: cyclohexylmethyl 4-nitrobenzenesulfonate Openeye Name: cyclohexylmethyl 4-nitrobenzenesulfonate CAS Name: 4-nitrobenzenesulfonic acid cyclohexylmethyl ester IUPAC Name: cyclohexylmethyl 4-nitrobenzenesulfonate Traditional Name: 4-nitrobenzenesulfonic acid cyclohexylmethyl ester Formula: C13H17NO5S MolecularWeight: 299.34278

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)COS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)COS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H17NO5S/c15-14(16)12-6-8-13(9-7-12)20(17,18)19-10-11-4-2-1-3-5-11/h6-9,11H,1-5,10H2