2-(4-methoxyphenoxy)ethyl 1-(3,4-dimethylphenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: 2-(4-methoxyphenoxy)ethyl 1-(3,4-dimethylphenyl)sulfonylpiperidine-4-carboxylate Openeye Name: 2-(4-methoxyphenoxy)ethyl 1-(3,4-dimethylphenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-(3,4-dimethylphenyl)sulfonyl-4-piperidinecarboxylic acid 2-(4-methoxyphenoxy)ethyl ester IUPAC Name: 2-(4-methoxyphenoxy)ethyl 1-(3,4-dimethylphenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-(3,4-dimethylphenyl)sulfonylisonipecotic acid 2-(4-methoxyphenoxy)ethyl ester Formula: C23H29NO6S MolecularWeight: 447.54446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)OCCOC3=CC=C(C=C3)OC)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)OCCOC3=CC=C(C=C3)OC)C

InChI

InChI=1S/C23H29NO6S/c1-17-4-9-22(16-18(17)2)31(26,27)24-12-10-19(11-13-24)23(25)30-15-14-29-21-7-5-20(28-3)6-8-21/h4-9,16,19H,10-15H2,1-3H3