ethyl 4-[(4-methoxyphenyl)methyl]-1-(phenylsulfonyl)piperidine-4-carboxylate

Systemtic Name: ethyl 4-[(4-methoxyphenyl)methyl]-1-(phenylsulfonyl)piperidine-4-carboxylate Openeye Name: ethyl 1-(benzenesulfonyl)-4-[(4-methoxyphenyl)methyl]piperidine-4-carboxylate CAS Name: 1-(benzenesulfonyl)-4-[(4-methoxyphenyl)methyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(benzenesulfonyl)-4-[(4-methoxyphenyl)methyl]piperidine-4-carboxylate Traditional Name: 1-besyl-4-p-anisyl-isonipecotic acid ethyl ester Formula: C22H27NO5S MolecularWeight: 417.51848

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)S(=O)(=O)C2=CC=CC=C2)CC3=CC=C(C=C3)OC

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)S(=O)(=O)C2=CC=CC=C2)CC3=CC=C(C=C3)OC

InChI

InChI=1S/C22H27NO5S/c1-3-28-21(24)22(17-18-9-11-19(27-2)12-10-18)13-15-23(16-14-22)29(25,26)20-7-5-4-6-8-20/h4-12H,3,13-17H2,1-2H3