methyl 1-[(4-cyanophenyl)methylsulfonyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[(4-cyanophenyl)methylsulfonyl]piperidine-4-carboxylate Openeye Name: methyl 1-[(4-cyanophenyl)methylsulfonyl]piperidine-4-carboxylate CAS Name: 1-[(4-cyanophenyl)methylsulfonyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[(4-cyanophenyl)methylsulfonyl]piperidine-4-carboxylate Traditional Name: 1-(4-cyanobenzyl)sulfonylisonipecotic acid methyl ester Formula: C15H18N2O4S MolecularWeight: 322.37942

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)S(=O)(=O)CC2=CC=C(C=C2)C#N

Isomeric SMILES

COC(=O)C1CCN(CC1)S(=O)(=O)CC2=CC=C(C=C2)C#N

InChI

InChI=1S/C15H18N2O4S/c1-21-15(18)14-6-8-17(9-7-14)22(19,20)11-13-4-2-12(10-16)3-5-13/h2-5,14H,6-9,11H2,1H3