3-[[4-[(2S,6S)-2,6-dimethylpiperidin-1-yl]sulfonylphenyl]sulfamoyl]benzoate

Systemtic Name: 3-[[4-[(2S,6S)-2,6-dimethylpiperidin-1-yl]sulfonylphenyl]sulfamoyl]benzoate Openeye Name: 3-[[4-[[(2S,6S)-2,6-dimethyl-1-piperidyl]sulfonyl]phenyl]sulfamoyl]benzoate CAS Name: 3-[[4-[[(2S,6S)-2,6-dimethyl-1-piperidinyl]sulfonyl]phenyl]sulfamoyl]benzoate IUPAC Name: 3-[[4-[(2S,6S)-2,6-dimethylpiperidin-1-yl]sulfonylphenyl]sulfamoyl]benzoate Traditional Name: 3-[[4-[(2S,6S)-2,6-dimethylpiperidino]sulfonylphenyl]sulfamoyl]benzoate Formula: C20H23N2O6S2- MolecularWeight: 451.53642

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1S(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC(=C3)C(=O)[O-])C

Isomeric SMILES

C[C@H]1CCC[C@@H](N1S(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC(=C3)C(=O)[O-])C

InChI

InChI=1S/C20H24N2O6S2/c1-14-5-3-6-15(2)22(14)30(27,28)18-11-9-17(10-12-18)21-29(25,26)19-8-4-7-16(13-19)20(23)24/h4,7-15,21H,3,5-6H2,1-2H3,(H,23,24)/p-1/t14-,15-/m0/s1