2-[[1-(3-ethanoylphenyl)sulfonylpiperidin-4-yl]carbonylamino]ethyl-diethyl-azanium

Systemtic Name: 2-[[1-(3-ethanoylphenyl)sulfonylpiperidin-4-yl]carbonylamino]ethyl-diethyl-azanium Openeye Name: 2-[[1-(3-acetylphenyl)sulfonylpiperidine-4-carbonyl]amino]ethyl-diethyl-ammonium CAS Name: 2-[[[1-(3-acetylphenyl)sulfonyl-4-piperidinyl]-oxomethyl]amino]ethyl-diethylammonium IUPAC Name: 2-[[1-(3-acetylphenyl)sulfonylpiperidine-4-carbonyl]amino]ethyl-diethylazanium Traditional Name: 2-[[1-(3-acetylphenyl)sulfonylisonipecotoyl]amino]ethyl-diethyl-ammonium Formula: C20H32N3O4S+ MolecularWeight: 410.55078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)C

Isomeric SMILES

CC[NH+](CC)CCNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)C

InChI

InChI=1S/C20H31N3O4S/c1-4-22(5-2)14-11-21-20(25)17-9-12-23(13-10-17)28(26,27)19-8-6-7-18(15-19)16(3)24/h6-8,15,17H,4-5,9-14H2,1-3H3,(H,21,25)/p+1