cyanomethyl 1-(4-ethoxyphenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: cyanomethyl 1-(4-ethoxyphenyl)sulfonylpiperidine-4-carboxylate Openeye Name: cyanomethyl 1-(4-ethoxyphenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-(4-ethoxyphenyl)sulfonyl-4-piperidinecarboxylic acid cyanomethyl ester IUPAC Name: cyanomethyl 1-(4-ethoxyphenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-p-phenetylsulfonylisonipecotic acid cyanomethyl ester Formula: C16H20N2O5S MolecularWeight: 352.4054

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)OCC#N

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)OCC#N

InChI

InChI=1S/C16H20N2O5S/c1-2-22-14-3-5-15(6-4-14)24(20,21)18-10-7-13(8-11-18)16(19)23-12-9-17/h3-6,13H,2,7-8,10-12H2,1H3