4-[[(4-tert-butylphenyl)sulfonyl-[(2-methylphenyl)methyl]amino]methyl]-N-oxidanidyl-cyclohexane-1-carboxamide

Systemtic Name: 4-[[(4-tert-butylphenyl)sulfonyl-[(2-methylphenyl)methyl]amino]methyl]-N-oxidanidyl-cyclohexane-1-carboxamide Openeye Name: 4-[[(4-tert-butylphenyl)sulfonyl-(o-tolylmethyl)amino]methyl]-N-oxido-cyclohexanecarboxamide CAS Name: 4-[[(4-tert-butylphenyl)sulfonyl-[(2-methylphenyl)methyl]amino]methyl]-N-oxido-1-cyclohexanecarboxamide IUPAC Name: 4-[[(4-tert-butylphenyl)sulfonyl-[(2-methylphenyl)methyl]amino]methyl]-N-oxidocyclohexane-1-carboxamide Traditional Name: 4-[[(4-tert-butylphenyl)sulfonyl-(2-methylbenzyl)amino]methyl]-N-oxido-cyclohexanecarboxamide Formula: C26H35N2O4S- MolecularWeight: 471.6321

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN(CC2CCC(CC2)C(=O)N[O-])S(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC1=CC=CC=C1CN(CC2CCC(CC2)C(=O)N[O-])S(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C26H35N2O4S/c1-19-7-5-6-8-22(19)18-28(17-20-9-11-21(12-10-20)25(29)27-30)33(31,32)24-15-13-23(14-16-24)26(2,3)4/h5-8,13-16,20-21H,9-12,17-18H2,1-4H3,(H-,27,29,30)/q-1