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

Systemtic Name: 3-methyl-4-[[(3S)-3-methylpiperidin-1-yl]sulfonylamino]benzoate Openeye Name: 3-methyl-4-[[(3S)-3-methyl-1-piperidyl]sulfonylamino]benzoate CAS Name: 3-methyl-4-[[(3S)-3-methyl-1-piperidinyl]sulfonylamino]benzoate IUPAC Name: 3-methyl-4-[[(3S)-3-methylpiperidin-1-yl]sulfonylamino]benzoate Traditional Name: 3-methyl-4-[[(3S)-3-methylpiperidino]sulfonylamino]benzoate Formula: C14H19N2O4S- MolecularWeight: 311.37666

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20N2O4S/c1-10-4-3-7-16(9-10)21(19,20)15-13-6-5-12(14(17)18)8-11(13)2/h5-6,8,10,15H,3-4,7,9H2,1-2H3,(H,17,18)/p-1/t10-/m0/s1