3-(azepan-1-ylcarbonyl)-4-methoxy-N-methyl-N-[(1R,2R)-2-oxidanylcyclohexyl]benzenesulfonamide

Systemtic Name: 3-(azepan-1-ylcarbonyl)-4-methoxy-N-methyl-N-[(1R,2R)-2-oxidanylcyclohexyl]benzenesulfonamide Openeye Name: 3-(azepane-1-carbonyl)-N-[(1R,2R)-2-hydroxycyclohexyl]-4-methoxy-N-methyl-benzenesulfonamide CAS Name: 3-[1-azepanyl(oxo)methyl]-N-[(1R,2R)-2-hydroxycyclohexyl]-4-methoxy-N-methylbenzenesulfonamide IUPAC Name: 3-(azepane-1-carbonyl)-N-[(1R,2R)-2-hydroxycyclohexyl]-4-methoxy-N-methylbenzenesulfonamide Traditional Name: 3-(azepane-1-carbonyl)-N-[(1R,2R)-2-hydroxycyclohexyl]-4-methoxy-N-methyl-benzenesulfonamide Formula: C21H32N2O5S MolecularWeight: 424.55418

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1O)S(=O)(=O)C2=CC(=C(C=C2)OC)C(=O)N3CCCCCC3

Isomeric SMILES

CN([C@@H]1CCCC[C@H]1O)S(=O)(=O)C2=CC(=C(C=C2)OC)C(=O)N3CCCCCC3

InChI

InChI=1S/C21H32N2O5S/c1-22(18-9-5-6-10-19(18)24)29(26,27)16-11-12-20(28-2)17(15-16)21(25)23-13-7-3-4-8-14-23/h11-12,15,18-19,24H,3-10,13-14H2,1-2H3/t18-,19-/m1/s1