ethyl 4-[(4-methoxyphenyl)methyl]-1-thiophen-2-ylsulfonyl-piperidine-4-carboxylate

Systemtic Name: ethyl 4-[(4-methoxyphenyl)methyl]-1-thiophen-2-ylsulfonyl-piperidine-4-carboxylate Openeye Name: ethyl 4-[(4-methoxyphenyl)methyl]-1-(2-thienylsulfonyl)piperidine-4-carboxylate CAS Name: 4-[(4-methoxyphenyl)methyl]-1-thiophen-2-ylsulfonyl-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(4-methoxyphenyl)methyl]-1-thiophen-2-ylsulfonylpiperidine-4-carboxylate Traditional Name: 4-p-anisyl-1-(2-thienylsulfonyl)isonipecotic acid ethyl ester Formula: C20H25NO5S2 MolecularWeight: 423.5462

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)S(=O)(=O)C2=CC=CS2)CC3=CC=C(C=C3)OC

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)S(=O)(=O)C2=CC=CS2)CC3=CC=C(C=C3)OC

InChI

InChI=1S/C20H25NO5S2/c1-3-26-19(22)20(15-16-6-8-17(25-2)9-7-16)10-12-21(13-11-20)28(23,24)18-5-4-14-27-18/h4-9,14H,3,10-13,15H2,1-2H3