1-[(3S)-2-oxidanylideneoxolan-3-yl]-N-(4-sulfamoylphenyl)piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(3S)-2-oxidanylideneoxolan-3-yl]-N-(4-sulfamoylphenyl)piperidin-1-ium-4-carboxamide Openeye Name: 1-[(3S)-2-oxotetrahydrofuran-3-yl]-N-(4-sulfamoylphenyl)piperidin-1-ium-4-carboxamide CAS Name: 1-[(3S)-2-oxo-3-oxolanyl]-N-(4-sulfamoylphenyl)-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(3S)-2-oxooxolan-3-yl]-N-(4-sulfamoylphenyl)piperidin-1-ium-4-carboxamide Traditional Name: 1-[(3S)-2-ketotetrahydrofuran-3-yl]-N-(4-sulfamoylphenyl)piperidin-1-ium-4-carboxamide Formula: C16H22N3O5S+ MolecularWeight: 368.42798

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)NC2=CC=C(C=C2)S(=O)(=O)N)C3CCOC3=O

Isomeric SMILES

C1COC(=O)[C@H]1[NH+]2CCC(CC2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C16H21N3O5S/c17-25(22,23)13-3-1-12(2-4-13)18-15(20)11-5-8-19(9-6-11)14-7-10-24-16(14)21/h1-4,11,14H,5-10H2,(H,18,20)(H2,17,22,23)/p+1/t14-/m0/s1