1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(4-thiophen-2-ylphenyl)sulfonyl-piperidine

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(4-thiophen-2-ylphenyl)sulfonyl-piperidine Openeye Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-4-[4-(2-thienyl)phenyl]sulfonyl-piperidine CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(4-thiophen-2-ylphenyl)sulfonylpiperidine IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(4-thiophen-2-ylphenyl)sulfonylpiperidine Traditional Name: 1-homoveratryl-4-[4-(2-thienyl)phenyl]sulfonyl-piperidine Formula: C25H29NO4S2 MolecularWeight: 471.63206

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN2CCC(CC2)S(=O)(=O)C3=CC=C(C=C3)C4=CC=CS4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN2CCC(CC2)S(=O)(=O)C3=CC=C(C=C3)C4=CC=CS4)OC

InChI

InChI=1S/C25H29NO4S2/c1-29-23-10-5-19(18-24(23)30-2)11-14-26-15-12-22(13-16-26)32(27,28)21-8-6-20(7-9-21)25-4-3-17-31-25/h3-10,17-18,22H,11-16H2,1-2H3