N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]-4-(2-oxidanylidenepyrrolidin-1-yl)benzenesulfonamide

Systemtic Name: N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]-4-(2-oxidanylidenepyrrolidin-1-yl)benzenesulfonamide Openeye Name: N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide CAS Name: N-[[1-(4-morpholin-4-iumyl)cyclohexyl]methyl]-4-(2-oxo-1-pyrrolidinyl)benzenesulfonamide IUPAC Name: N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide Traditional Name: 4-(2-ketopyrrolidino)-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]benzenesulfonamide Formula: C21H32N3O4S+ MolecularWeight: 422.56148

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CNS(=O)(=O)C2=CC=C(C=C2)N3CCCC3=O)[NH+]4CCOCC4

Isomeric SMILES

C1CCC(CC1)(CNS(=O)(=O)C2=CC=C(C=C2)N3CCCC3=O)[NH+]4CCOCC4

InChI

InChI=1S/C21H31N3O4S/c25-20-5-4-12-24(20)18-6-8-19(9-7-18)29(26,27)22-17-21(10-2-1-3-11-21)23-13-15-28-16-14-23/h6-9,22H,1-5,10-17H2/p+1