N-(4-cyanophenyl)-1-methylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(4-cyanophenyl)-1-methylsulfonyl-piperidine-4-carboxamide Openeye Name: N-(4-cyanophenyl)-1-methylsulfonyl-piperidine-4-carboxamide CAS Name: N-(4-cyanophenyl)-1-methylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-(4-cyanophenyl)-1-methylsulfonylpiperidine-4-carboxamide Traditional Name: N-(4-cyanophenyl)-1-mesyl-isonipecotamide Formula: C14H17N3O3S MolecularWeight: 307.36808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(CC1)C(=O)NC2=CC=C(C=C2)C#N

Isomeric SMILES

CS(=O)(=O)N1CCC(CC1)C(=O)NC2=CC=C(C=C2)C#N

InChI

InChI=1S/C14H17N3O3S/c1-21(19,20)17-8-6-12(7-9-17)14(18)16-13-4-2-11(10-15)3-5-13/h2-5,12H,6-9H2,1H3,(H,16,18)