2-[N-[4-[(4-methylphenyl)sulfonylamino]phenyl]-C-oxidanidyl-carbonimidoyl]cyclohexane-1-carboxylate

Systemtic Name: 2-[N-[4-[(4-methylphenyl)sulfonylamino]phenyl]-C-oxidanidyl-carbonimidoyl]cyclohexane-1-carboxylate Openeye Name: 2-[C-oxido-N-[4-(p-tolylsulfonylamino)phenyl]carbonimidoyl]cyclohexanecarboxylate CAS Name: 2-[[4-[(4-methylphenyl)sulfonylamino]phenyl]imino-oxidomethyl]-1-cyclohexanecarboxylate IUPAC Name: 2-[N-[4-[(4-methylphenyl)sulfonylamino]phenyl]-C-oxidocarbonimidoyl]cyclohexane-1-carboxylate Traditional Name: 2-[C-oxido-N-[4-(tosylamino)phenyl]carbonimidoyl]cyclohexanecarboxylate Formula: C21H22N2O5S-2 MolecularWeight: 414.47478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)N=C(C3CCCCC3C(=O)[O-])[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)N=C(C3CCCCC3C(=O)[O-])[O-]

InChI

InChI=1S/C21H24N2O5S/c1-14-6-12-17(13-7-14)29(27,28)23-16-10-8-15(9-11-16)22-20(24)18-4-2-3-5-19(18)21(25)26/h6-13,18-19,23H,2-5H2,1H3,(H,22,24)(H,25,26)/p-2