N-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]ethanamide

Systemtic Name: N-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]ethanamide Openeye Name: N-[4-methoxy-3-(1-piperidylsulfonyl)phenyl]-2-[(2S)-2-methylpiperidin-1-ium-1-yl]acetamide CAS Name: N-[4-methoxy-3-(1-piperidinylsulfonyl)phenyl]-2-[(2S)-2-methyl-1-piperidin-1-iumyl]acetamide IUPAC Name: N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]acetamide Traditional Name: N-(4-methoxy-3-piperidinosulfonyl-phenyl)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]acetamide Formula: C20H32N3O4S+ MolecularWeight: 410.55078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CC(=O)NC2=CC(=C(C=C2)OC)S(=O)(=O)N3CCCCC3

Isomeric SMILES

C[C@H]1CCCC[NH+]1CC(=O)NC2=CC(=C(C=C2)OC)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C20H31N3O4S/c1-16-8-4-7-11-22(16)15-20(24)21-17-9-10-18(27-2)19(14-17)28(25,26)23-12-5-3-6-13-23/h9-10,14,16H,3-8,11-13,15H2,1-2H3,(H,21,24)/p+1/t16-/m0/s1