1-[(1S)-2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl]-N-(4-sulfamoylphenyl)piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(1S)-2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl]-N-(4-sulfamoylphenyl)piperidin-1-ium-4-carboxamide Openeye Name: 1-[(1S)-2-(cyclopropylamino)-2-oxo-1-phenyl-ethyl]-N-(4-sulfamoylphenyl)piperidin-1-ium-4-carboxamide CAS Name: 1-[(1S)-2-(cyclopropylamino)-2-oxo-1-phenylethyl]-N-(4-sulfamoylphenyl)-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(1S)-2-(cyclopropylamino)-2-oxo-1-phenylethyl]-N-(4-sulfamoylphenyl)piperidin-1-ium-4-carboxamide Traditional Name: 1-[(1S)-2-(cyclopropylamino)-2-keto-1-phenyl-ethyl]-N-(4-sulfamoylphenyl)piperidin-1-ium-4-carboxamide Formula: C23H29N4O4S+ MolecularWeight: 457.56576

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C(C2=CC=CC=C2)[NH+]3CCC(CC3)C(=O)NC4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

C1CC1NC(=O)[C@H](C2=CC=CC=C2)[NH+]3CCC(CC3)C(=O)NC4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C23H28N4O4S/c24-32(30,31)20-10-8-19(9-11-20)25-22(28)17-12-14-27(15-13-17)21(16-4-2-1-3-5-16)23(29)26-18-6-7-18/h1-5,8-11,17-18,21H,6-7,12-15H2,(H,25,28)(H,26,29)(H2,24,30,31)/p+1/t21-/m0/s1