cyanomethyl 1-(3-ethanoylphenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: cyanomethyl 1-(3-ethanoylphenyl)sulfonylpiperidine-4-carboxylate Openeye Name: cyanomethyl 1-(3-acetylphenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-(3-acetylphenyl)sulfonyl-4-piperidinecarboxylic acid cyanomethyl ester IUPAC Name: cyanomethyl 1-(3-acetylphenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-(3-acetylphenyl)sulfonylisonipecotic acid cyanomethyl ester Formula: C16H18N2O5S MolecularWeight: 350.38952

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCC(CC2)C(=O)OCC#N

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCC(CC2)C(=O)OCC#N

InChI

InChI=1S/C16H18N2O5S/c1-12(19)14-3-2-4-15(11-14)24(21,22)18-8-5-13(6-9-18)16(20)23-10-7-17/h2-4,11,13H,5-6,8-10H2,1H3