N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]-2-oxidanylidene-3,4-dihydro-1H-quinoline-6-sulfonamide

Systemtic Name: N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]-2-oxidanylidene-3,4-dihydro-1H-quinoline-6-sulfonamide Openeye Name: N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]-2-oxo-3,4-dihydro-1H-quinoline-6-sulfonamide CAS Name: N-[[1-(4-morpholin-4-iumyl)cyclohexyl]methyl]-2-oxo-3,4-dihydro-1H-quinoline-6-sulfonamide IUPAC Name: N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]-2-oxo-3,4-dihydro-1H-quinoline-6-sulfonamide Traditional Name: 2-keto-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]-3,4-dihydro-1H-quinoline-6-sulfonamide Formula: C20H30N3O4S+ MolecularWeight: 408.5349

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CNS(=O)(=O)C2=CC3=C(C=C2)NC(=O)CC3)[NH+]4CCOCC4

Isomeric SMILES

C1CCC(CC1)(CNS(=O)(=O)C2=CC3=C(C=C2)NC(=O)CC3)[NH+]4CCOCC4

InChI

InChI=1S/C20H29N3O4S/c24-19-7-4-16-14-17(5-6-18(16)22-19)28(25,26)21-15-20(8-2-1-3-9-20)23-10-12-27-13-11-23/h5-6,14,21H,1-4,7-13,15H2,(H,22,24)/p+1