pyridin-2-ylmethyl 1-(4-ethoxyphenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: pyridin-2-ylmethyl 1-(4-ethoxyphenyl)sulfonylpiperidine-4-carboxylate Openeye Name: 2-pyridylmethyl 1-(4-ethoxyphenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-(4-ethoxyphenyl)sulfonyl-4-piperidinecarboxylic acid 2-pyridinylmethyl ester IUPAC Name: pyridin-2-ylmethyl 1-(4-ethoxyphenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-p-phenetylsulfonylisonipecotic acid 2-pyridylmethyl ester Formula: C20H24N2O5S MolecularWeight: 404.47996

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)OCC3=CC=CC=N3

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)OCC3=CC=CC=N3

InChI

InChI=1S/C20H24N2O5S/c1-2-26-18-6-8-19(9-7-18)28(24,25)22-13-10-16(11-14-22)20(23)27-15-17-5-3-4-12-21-17/h3-9,12,16H,2,10-11,13-15H2,1H3