(2R)-N-(3-chloranyl-4-methoxy-phenyl)-2-[4-(thiophen-2-ylsulfonylamino)piperidin-1-ium-1-yl]propanamide

Systemtic Name: (2R)-N-(3-chloranyl-4-methoxy-phenyl)-2-[4-(thiophen-2-ylsulfonylamino)piperidin-1-ium-1-yl]propanamide Openeye Name: (2R)-N-(3-chloro-4-methoxy-phenyl)-2-[4-(2-thienylsulfonylamino)piperidin-1-ium-1-yl]propanamide CAS Name: (2R)-N-(3-chloro-4-methoxyphenyl)-2-[4-(thiophen-2-ylsulfonylamino)-1-piperidin-1-iumyl]propanamide IUPAC Name: (2R)-N-(3-chloro-4-methoxyphenyl)-2-[4-(thiophen-2-ylsulfonylamino)piperidin-1-ium-1-yl]propanamide Traditional Name: (2R)-N-(3-chloro-4-methoxy-phenyl)-2-[4-(2-thienylsulfonylamino)piperidin-1-ium-1-yl]propionamide Formula: C19H25ClN3O4S2+ MolecularWeight: 459.0025

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=C(C=C1)OC)Cl)[NH+]2CCC(CC2)NS(=O)(=O)C3=CC=CS3

Isomeric SMILES

C[C@H](C(=O)NC1=CC(=C(C=C1)OC)Cl)[NH+]2CCC(CC2)NS(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C19H24ClN3O4S2/c1-13(19(24)21-15-5-6-17(27-2)16(20)12-15)23-9-7-14(8-10-23)22-29(25,26)18-4-3-11-28-18/h3-6,11-14,22H,7-10H2,1-2H3,(H,21,24)/p+1/t13-/m1/s1