(4-cyclohexylphenyl) 3-nitrobenzenesulfonate

Systemtic Name: (4-cyclohexylphenyl) 3-nitrobenzenesulfonate Openeye Name: (4-cyclohexylphenyl) 3-nitrobenzenesulfonate CAS Name: 3-nitrobenzenesulfonic acid (4-cyclohexylphenyl) ester IUPAC Name: (4-cyclohexylphenyl) 3-nitrobenzenesulfonate Traditional Name: 3-nitrobenzenesulfonic acid (4-cyclohexylphenyl) ester Formula: C18H19NO5S MolecularWeight: 361.41216

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)OS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)OS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H19NO5S/c20-19(21)16-7-4-8-18(13-16)25(22,23)24-17-11-9-15(10-12-17)14-5-2-1-3-6-14/h4,7-14H,1-3,5-6H2