2-(2,6-dimethylphenoxy)ethyl 1-(4-ethoxyphenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: 2-(2,6-dimethylphenoxy)ethyl 1-(4-ethoxyphenyl)sulfonylpiperidine-4-carboxylate Openeye Name: 2-(2,6-dimethylphenoxy)ethyl 1-(4-ethoxyphenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-(4-ethoxyphenyl)sulfonyl-4-piperidinecarboxylic acid 2-(2,6-dimethylphenoxy)ethyl ester IUPAC Name: 2-(2,6-dimethylphenoxy)ethyl 1-(4-ethoxyphenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-p-phenetylsulfonylisonipecotic acid 2-(2,6-dimethylphenoxy)ethyl ester Formula: C24H31NO6S MolecularWeight: 461.57104

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)OCCOC3=C(C=CC=C3C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)OCCOC3=C(C=CC=C3C)C

InChI

InChI=1S/C24H31NO6S/c1-4-29-21-8-10-22(11-9-21)32(27,28)25-14-12-20(13-15-25)24(26)31-17-16-30-23-18(2)6-5-7-19(23)3/h5-11,20H,4,12-17H2,1-3H3