N-[(1R)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]-2-oxidanylidene-3,4-dihydro-1H-quinoline-6-sulfonamide

Systemtic Name: N-[(1R)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]-2-oxidanylidene-3,4-dihydro-1H-quinoline-6-sulfonamide Openeye Name: N-[(1R)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]-2-oxo-3,4-dihydro-1H-quinoline-6-sulfonamide CAS Name: N-[(1R)-2-(4-morpholin-4-iumyl)-1-phenylethyl]-2-oxo-3,4-dihydro-1H-quinoline-6-sulfonamide IUPAC Name: N-[(1R)-2-morpholin-4-ium-4-yl-1-phenylethyl]-2-oxo-3,4-dihydro-1H-quinoline-6-sulfonamide Traditional Name: 2-keto-N-[(1R)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]-3,4-dihydro-1H-quinoline-6-sulfonamide Formula: C21H26N3O4S+ MolecularWeight: 416.51384

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)NC2=C1C=C(C=C2)S(=O)(=O)NC(C[NH+]3CCOCC3)C4=CC=CC=C4

Isomeric SMILES

C1CC(=O)NC2=C1C=C(C=C2)S(=O)(=O)N[C@@H](C[NH+]3CCOCC3)C4=CC=CC=C4

InChI

InChI=1S/C21H25N3O4S/c25-21-9-6-17-14-18(7-8-19(17)22-21)29(26,27)23-20(16-4-2-1-3-5-16)15-24-10-12-28-13-11-24/h1-5,7-8,14,20,23H,6,9-13,15H2,(H,22,25)/p+1/t20-/m0/s1