5-[[(3S)-3-methylpiperidin-1-yl]sulfonylamino]-2-oxidanyl-benzoate

Systemtic Name: 5-[[(3S)-3-methylpiperidin-1-yl]sulfonylamino]-2-oxidanyl-benzoate Openeye Name: 2-hydroxy-5-[[(3S)-3-methyl-1-piperidyl]sulfonylamino]benzoate CAS Name: 2-hydroxy-5-[[(3S)-3-methyl-1-piperidinyl]sulfonylamino]benzoate IUPAC Name: 2-hydroxy-5-[[(3S)-3-methylpiperidin-1-yl]sulfonylamino]benzoate Traditional Name: 2-hydroxy-5-[[(3S)-3-methylpiperidino]sulfonylamino]benzoate Formula: C13H17N2O5S- MolecularWeight: 313.34948

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)NC2=CC(=C(C=C2)O)C(=O)[O-]

Isomeric SMILES

C[C@H]1CCCN(C1)S(=O)(=O)NC2=CC(=C(C=C2)O)C(=O)[O-]

InChI

InChI=1S/C13H18N2O5S/c1-9-3-2-6-15(8-9)21(19,20)14-10-4-5-12(16)11(7-10)13(17)18/h4-5,7,9,14,16H,2-3,6,8H2,1H3,(H,17,18)/p-1/t9-/m0/s1