4-[(4-oxidanylidenepiperidin-1-yl)sulfonylmethyl]benzenecarbonitrile

Systemtic Name: 4-[(4-oxidanylidenepiperidin-1-yl)sulfonylmethyl]benzenecarbonitrile Openeye Name: 4-[(4-oxo-1-piperidyl)sulfonylmethyl]benzonitrile CAS Name: 4-[(4-oxo-1-piperidinyl)sulfonylmethyl]benzonitrile IUPAC Name: 4-[(4-oxopiperidin-1-yl)sulfonylmethyl]benzonitrile Traditional Name: 4-[(4-ketopiperidino)sulfonylmethyl]benzonitrile Formula: C13H14N2O3S MolecularWeight: 278.32686

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1=O)S(=O)(=O)CC2=CC=C(C=C2)C#N

Isomeric SMILES

C1CN(CCC1=O)S(=O)(=O)CC2=CC=C(C=C2)C#N

InChI

InChI=1S/C13H14N2O3S/c14-9-11-1-3-12(4-2-11)10-19(17,18)15-7-5-13(16)6-8-15/h1-4H,5-8,10H2