4-[2,5-dimethyl-3-[2-[(3S)-3-morpholin-4-ylcarbonylpiperidin-1-ium-1-yl]ethanoyl]pyrrol-1-yl]benzenesulfonamide

Systemtic Name: 4-[2,5-dimethyl-3-[2-[(3S)-3-morpholin-4-ylcarbonylpiperidin-1-ium-1-yl]ethanoyl]pyrrol-1-yl]benzenesulfonamide Openeye Name: 4-[2,5-dimethyl-3-[2-[(3S)-3-(morpholine-4-carbonyl)piperidin-1-ium-1-yl]acetyl]pyrrol-1-yl]benzenesulfonamide CAS Name: 4-[2,5-dimethyl-3-[2-[(3S)-3-[4-morpholinyl(oxo)methyl]-1-piperidin-1-iumyl]-1-oxoethyl]-1-pyrrolyl]benzenesulfonamide IUPAC Name: 4-[2,5-dimethyl-3-[2-[(3S)-3-(morpholine-4-carbonyl)piperidin-1-ium-1-yl]acetyl]pyrrol-1-yl]benzenesulfonamide Traditional Name: 4-[2,5-dimethyl-3-[2-[(3S)-3-(morpholine-4-carbonyl)piperidin-1-ium-1-yl]acetyl]pyrrol-1-yl]benzenesulfonamide Formula: C24H33N4O5S+ MolecularWeight: 489.60762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)S(=O)(=O)N)C)C(=O)C[NH+]3CCCC(C3)C(=O)N4CCOCC4

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)S(=O)(=O)N)C)C(=O)C[NH+]3CCC[C@@H](C3)C(=O)N4CCOCC4

InChI

InChI=1S/C24H32N4O5S/c1-17-14-22(18(2)28(17)20-5-7-21(8-6-20)34(25,31)32)23(29)16-26-9-3-4-19(15-26)24(30)27-10-12-33-13-11-27/h5-8,14,19H,3-4,9-13,15-16H2,1-2H3,(H2,25,31,32)/p+1/t19-/m0/s1