cyanomethyl 1-(4-ethanoylphenyl)sulfonylpiperidine-2-carboxylate

Systemtic Name: cyanomethyl 1-(4-ethanoylphenyl)sulfonylpiperidine-2-carboxylate Openeye Name: cyanomethyl 1-(4-acetylphenyl)sulfonylpiperidine-2-carboxylate CAS Name: 1-(4-acetylphenyl)sulfonyl-2-piperidinecarboxylic acid cyanomethyl ester IUPAC Name: cyanomethyl 1-(4-acetylphenyl)sulfonylpiperidine-2-carboxylate Traditional Name: 1-(4-acetylphenyl)sulfonylpipecolinic acid cyanomethyl ester Formula: C16H18N2O5S MolecularWeight: 350.38952

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCCC2C(=O)OCC#N

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCCC2C(=O)OCC#N

InChI

InChI=1S/C16H18N2O5S/c1-12(19)13-5-7-14(8-6-13)24(21,22)18-10-3-2-4-15(18)16(20)23-11-9-17/h5-8,15H,2-4,10-11H2,1H3