ethyl (3S)-1-(4-cyanophenyl)sulfonylpiperidine-3-carboxylate

Systemtic Name: ethyl (3S)-1-(4-cyanophenyl)sulfonylpiperidine-3-carboxylate Openeye Name: ethyl (3S)-1-(4-cyanophenyl)sulfonylpiperidine-3-carboxylate CAS Name: (3S)-1-(4-cyanophenyl)sulfonyl-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3S)-1-(4-cyanophenyl)sulfonylpiperidine-3-carboxylate Traditional Name: (3S)-1-(4-cyanophenyl)sulfonylnipecotic acid ethyl ester Formula: C15H18N2O4S MolecularWeight: 322.37942

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)C#N

Isomeric SMILES

CCOC(=O)[C@H]1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C15H18N2O4S/c1-2-21-15(18)13-4-3-9-17(11-13)22(19,20)14-7-5-12(10-16)6-8-14/h5-8,13H,2-4,9,11H2,1H3/t13-/m0/s1