cyanomethyl 3-(4-piperidin-1-ylsulfonylphenyl)propanoate

Systemtic Name: cyanomethyl 3-(4-piperidin-1-ylsulfonylphenyl)propanoate Openeye Name: cyanomethyl 3-[4-(1-piperidylsulfonyl)phenyl]propanoate CAS Name: 3-[4-(1-piperidinylsulfonyl)phenyl]propanoic acid cyanomethyl ester IUPAC Name: cyanomethyl 3-(4-piperidin-1-ylsulfonylphenyl)propanoate Traditional Name: 3-(4-piperidinosulfonylphenyl)propionic acid cyanomethyl ester Formula: C16H20N2O4S MolecularWeight: 336.406

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)OCC#N

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)OCC#N

InChI

InChI=1S/C16H20N2O4S/c17-10-13-22-16(19)9-6-14-4-7-15(8-5-14)23(20,21)18-11-2-1-3-12-18/h4-5,7-8H,1-3,6,9,11-13H2