cyanomethyl 4-piperidin-1-ylsulfonylbenzoate

Systemtic Name: cyanomethyl 4-piperidin-1-ylsulfonylbenzoate Openeye Name: cyanomethyl 4-(1-piperidylsulfonyl)benzoate CAS Name: 4-(1-piperidinylsulfonyl)benzoic acid cyanomethyl ester IUPAC Name: cyanomethyl 4-piperidin-1-ylsulfonylbenzoate Traditional Name: 4-piperidinosulfonylbenzoic acid cyanomethyl ester Formula: C14H16N2O4S MolecularWeight: 308.35284

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16N2O4S/c15-8-11-20-14(17)12-4-6-13(7-5-12)21(18,19)16-9-2-1-3-10-16/h4-7H,1-3,9-11H2