(2S)-1-(2,4-dimethylphenyl)sulfonylpiperidine-2-carboxylate

Systemtic Name: (2S)-1-(2,4-dimethylphenyl)sulfonylpiperidine-2-carboxylate Openeye Name: (2S)-1-(2,4-dimethylphenyl)sulfonylpiperidine-2-carboxylate CAS Name: (2S)-1-(2,4-dimethylphenyl)sulfonyl-2-piperidinecarboxylate IUPAC Name: (2S)-1-(2,4-dimethylphenyl)sulfonylpiperidine-2-carboxylate Traditional Name: (2S)-1-(2,4-dimethylphenyl)sulfonylpipecolinate Formula: C14H18NO4S- MolecularWeight: 296.36202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)N2CCCCC2C(=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)N2CCCC[C@H]2C(=O)[O-])C

InChI

InChI=1S/C14H19NO4S/c1-10-6-7-13(11(2)9-10)20(18,19)15-8-4-3-5-12(15)14(16)17/h6-7,9,12H,3-5,8H2,1-2H3,(H,16,17)/p-1/t12-/m0/s1