(2S)-2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-N-(4-sulfamoylphenyl)propanamide

Systemtic Name: (2S)-2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-N-(4-sulfamoylphenyl)propanamide Openeye Name: (2S)-2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-N-(4-sulfamoylphenyl)propanamide CAS Name: (2S)-2-[(3R,5R)-3,5-dimethyl-1-piperidin-1-iumyl]-N-(4-sulfamoylphenyl)propanamide IUPAC Name: (2S)-2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-N-(4-sulfamoylphenyl)propanamide Traditional Name: (2S)-2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-N-(4-sulfamoylphenyl)propionamide Formula: C16H26N3O3S+ MolecularWeight: 340.46094

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C[NH+](C1)C(C)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N)C

Isomeric SMILES

C[C@@H]1C[C@H](C[NH+](C1)[C@@H](C)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N)C

InChI

InChI=1S/C16H25N3O3S/c1-11-8-12(2)10-19(9-11)13(3)16(20)18-14-4-6-15(7-5-14)23(17,21)22/h4-7,11-13H,8-10H2,1-3H3,(H,18,20)(H2,17,21,22)/p+1/t11-,12-,13+/m1/s1