(2R,6S)-6-methyl-N-[(4-sulfamoylphenyl)methyl]piperidin-1-ium-2-carboxamide

Systemtic Name: (2R,6S)-6-methyl-N-[(4-sulfamoylphenyl)methyl]piperidin-1-ium-2-carboxamide Openeye Name: (2R,6S)-6-methyl-N-[(4-sulfamoylphenyl)methyl]piperidin-1-ium-2-carboxamide CAS Name: (2R,6S)-6-methyl-N-[(4-sulfamoylphenyl)methyl]-2-piperidin-1-iumcarboxamide IUPAC Name: (2R,6S)-6-methyl-N-[(4-sulfamoylphenyl)methyl]piperidin-1-ium-2-carboxamide Traditional Name: (2R,6S)-6-methyl-N-(4-sulfamoylbenzyl)piperidin-1-ium-2-carboxamide Formula: C14H22N3O3S+ MolecularWeight: 312.40778

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC([NH2+]1)C(=O)NCC2=CC=C(C=C2)S(=O)(=O)N

Isomeric SMILES

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

InChI

InChI=1S/C14H21N3O3S/c1-10-3-2-4-13(17-10)14(18)16-9-11-5-7-12(8-6-11)21(15,19)20/h5-8,10,13,17H,2-4,9H2,1H3,(H,16,18)(H2,15,19,20)/p+1/t10-,13+/m0/s1