(3S)-1-(3-cyanophenyl)sulfonylpiperidine-3-carboxylate

Systemtic Name: (3S)-1-(3-cyanophenyl)sulfonylpiperidine-3-carboxylate Openeye Name: (3S)-1-(3-cyanophenyl)sulfonylpiperidine-3-carboxylate CAS Name: (3S)-1-(3-cyanophenyl)sulfonyl-3-piperidinecarboxylate IUPAC Name: (3S)-1-(3-cyanophenyl)sulfonylpiperidine-3-carboxylate Traditional Name: (3S)-1-(3-cyanophenyl)sulfonylnipecotate Formula: C13H13N2O4S- MolecularWeight: 293.31832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=CC(=C2)C#N)C(=O)[O-]

Isomeric SMILES

C1C[C@@H](CN(C1)S(=O)(=O)C2=CC=CC(=C2)C#N)C(=O)[O-]

InChI

InChI=1S/C13H14N2O4S/c14-8-10-3-1-5-12(7-10)20(18,19)15-6-2-4-11(9-15)13(16)17/h1,3,5,7,11H,2,4,6,9H2,(H,16,17)/p-1/t11-/m0/s1