(2R,4S)-4-oxidanyl-N-[(4-sulfamoylphenyl)methyl]pyrrolidin-1-ium-2-carboxamide

Systemtic Name: (2R,4S)-4-oxidanyl-N-[(4-sulfamoylphenyl)methyl]pyrrolidin-1-ium-2-carboxamide Openeye Name: (2R,4S)-4-hydroxy-N-[(4-sulfamoylphenyl)methyl]pyrrolidin-1-ium-2-carboxamide CAS Name: (2R,4S)-4-hydroxy-N-[(4-sulfamoylphenyl)methyl]-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2R,4S)-4-hydroxy-N-[(4-sulfamoylphenyl)methyl]pyrrolidin-1-ium-2-carboxamide Traditional Name: (2R,4S)-4-hydroxy-N-(4-sulfamoylbenzyl)pyrrolidin-1-ium-2-carboxamide Formula: C12H18N3O4S+ MolecularWeight: 300.35402

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C[NH2+]C1C(=O)NCC2=CC=C(C=C2)S(=O)(=O)N)O

Isomeric SMILES

C1[C@@H](C[NH2+][C@H]1C(=O)NCC2=CC=C(C=C2)S(=O)(=O)N)O

InChI

InChI=1S/C12H17N3O4S/c13-20(18,19)10-3-1-8(2-4-10)6-15-12(17)11-5-9(16)7-14-11/h1-4,9,11,14,16H,5-7H2,(H,15,17)(H2,13,18,19)/p+1/t9-,11+/m0/s1