2-methyl-5-[(2S)-2-methylpiperidin-1-yl]sulfonyl-benzoate

Systemtic Name: 2-methyl-5-[(2S)-2-methylpiperidin-1-yl]sulfonyl-benzoate Openeye Name: 2-methyl-5-[[(2S)-2-methyl-1-piperidyl]sulfonyl]benzoate CAS Name: 2-methyl-5-[[(2S)-2-methyl-1-piperidinyl]sulfonyl]benzoate IUPAC Name: 2-methyl-5-[(2S)-2-methylpiperidin-1-yl]sulfonylbenzoate Traditional Name: 2-methyl-5-[(2S)-2-methylpiperidino]sulfonyl-benzoate Formula: C14H18NO4S- MolecularWeight: 296.36202

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1S(=O)(=O)C2=CC(=C(C=C2)C)C(=O)[O-]

Isomeric SMILES

C[C@H]1CCCCN1S(=O)(=O)C2=CC(=C(C=C2)C)C(=O)[O-]

InChI

InChI=1S/C14H19NO4S/c1-10-6-7-12(9-13(10)14(16)17)20(18,19)15-8-4-3-5-11(15)2/h6-7,9,11H,3-5,8H2,1-2H3,(H,16,17)/p-1/t11-/m0/s1