(2S)-1-(3-ethanoylphenyl)sulfonylpiperidine-2-carboxylate

Systemtic Name: (2S)-1-(3-ethanoylphenyl)sulfonylpiperidine-2-carboxylate Openeye Name: (2S)-1-(3-acetylphenyl)sulfonylpiperidine-2-carboxylate CAS Name: (2S)-1-(3-acetylphenyl)sulfonyl-2-piperidinecarboxylate IUPAC Name: (2S)-1-(3-acetylphenyl)sulfonylpiperidine-2-carboxylate Traditional Name: (2S)-1-(3-acetylphenyl)sulfonylpipecolinate Formula: C14H16NO5S- MolecularWeight: 310.34554

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17NO5S/c1-10(16)11-5-4-6-12(9-11)21(19,20)15-8-3-2-7-13(15)14(17)18/h4-6,9,13H,2-3,7-8H2,1H3,(H,17,18)/p-1/t13-/m0/s1