2-chloranyl-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-5-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: 2-chloro-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-5-(1-piperidylsulfonyl)benzamide CAS Name: 2-chloro-N-[[2-(4-morpholin-4-iumylmethyl)phenyl]methyl]-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: 2-chloro-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-5-piperidin-1-ylsulfonylbenzamide Traditional Name: 2-chloro-N-[2-(morpholin-4-ium-4-ylmethyl)benzyl]-5-piperidinosulfonyl-benzamide Formula: C24H31ClN3O4S+ MolecularWeight: 493.03864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NCC3=CC=CC=C3C[NH+]4CCOCC4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NCC3=CC=CC=C3C[NH+]4CCOCC4

InChI

InChI=1S/C24H30ClN3O4S/c25-23-9-8-21(33(30,31)28-10-4-1-5-11-28)16-22(23)24(29)26-17-19-6-2-3-7-20(19)18-27-12-14-32-15-13-27/h2-3,6-9,16H,1,4-5,10-15,17-18H2,(H,26,29)/p+1