2-[[4-[(3R,5R)-3,5-dimethylpiperidin-1-yl]sulfonylphenyl]carbonylamino]ethyl-diethyl-azanium

Systemtic Name: 2-[[4-[(3R,5R)-3,5-dimethylpiperidin-1-yl]sulfonylphenyl]carbonylamino]ethyl-diethyl-azanium Openeye Name: 2-[[4-[[(3R,5R)-3,5-dimethyl-1-piperidyl]sulfonyl]benzoyl]amino]ethyl-diethyl-ammonium CAS Name: 2-[[[4-[[(3R,5R)-3,5-dimethyl-1-piperidinyl]sulfonyl]phenyl]-oxomethyl]amino]ethyl-diethylammonium IUPAC Name: 2-[[4-[(3R,5R)-3,5-dimethylpiperidin-1-yl]sulfonylbenzoyl]amino]ethyl-diethylazanium Traditional Name: 2-[[4-[(3R,5R)-3,5-dimethylpiperidino]sulfonylbenzoyl]amino]ethyl-diethyl-ammonium Formula: C20H34N3O3S+ MolecularWeight: 396.56726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCNC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CC(CC(C2)C)C

Isomeric SMILES

CC[NH+](CC)CCNC(=O)C1=CC=C(C=C1)S(=O)(=O)N2C[C@@H](C[C@H](C2)C)C

InChI

InChI=1S/C20H33N3O3S/c1-5-22(6-2)12-11-21-20(24)18-7-9-19(10-8-18)27(25,26)23-14-16(3)13-17(4)15-23/h7-10,16-17H,5-6,11-15H2,1-4H3,(H,21,24)/p+1/t16-,17-/m1/s1