(4-azanyl-3-nitro-phenyl) 4-cyclohexylbenzenesulfonate

Systemtic Name: (4-azanyl-3-nitro-phenyl) 4-cyclohexylbenzenesulfonate Openeye Name: (4-amino-3-nitro-phenyl) 4-cyclohexylbenzenesulfonate CAS Name: 4-cyclohexylbenzenesulfonic acid (4-amino-3-nitrophenyl) ester IUPAC Name: (4-amino-3-nitrophenyl) 4-cyclohexylbenzenesulfonate Traditional Name: 4-cyclohexylbenzenesulfonic acid (4-amino-3-nitro-phenyl) ester Formula: C18H20N2O5S MolecularWeight: 376.4268

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)S(=O)(=O)OC3=CC(=C(C=C3)N)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)S(=O)(=O)OC3=CC(=C(C=C3)N)[N+](=O)[O-]

InChI

InChI=1S/C18H20N2O5S/c19-17-11-8-15(12-18(17)20(21)22)25-26(23,24)16-9-6-14(7-10-16)13-4-2-1-3-5-13/h6-13H,1-5,19H2