4-[[(3S)-3-methylpiperidin-1-yl]sulfonylamino]benzoate

Systemtic Name: 4-[[(3S)-3-methylpiperidin-1-yl]sulfonylamino]benzoate Openeye Name: 4-[[(3S)-3-methyl-1-piperidyl]sulfonylamino]benzoate CAS Name: 4-[[(3S)-3-methyl-1-piperidinyl]sulfonylamino]benzoate IUPAC Name: 4-[[(3S)-3-methylpiperidin-1-yl]sulfonylamino]benzoate Traditional Name: 4-[[(3S)-3-methylpiperidino]sulfonylamino]benzoate Formula: C13H17N2O4S- MolecularWeight: 297.35008

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18N2O4S/c1-10-3-2-8-15(9-10)20(18,19)14-12-6-4-11(5-7-12)13(16)17/h4-7,10,14H,2-3,8-9H2,1H3,(H,16,17)/p-1/t10-/m0/s1