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

Systemtic Name: 2-(2,6-dimethylphenoxy)ethyl 1-(4-ethanoylphenyl)sulfonylpiperidine-2-carboxylate Openeye Name: 2-(2,6-dimethylphenoxy)ethyl 1-(4-acetylphenyl)sulfonylpiperidine-2-carboxylate CAS Name: 1-(4-acetylphenyl)sulfonyl-2-piperidinecarboxylic acid 2-(2,6-dimethylphenoxy)ethyl ester IUPAC Name: 2-(2,6-dimethylphenoxy)ethyl 1-(4-acetylphenyl)sulfonylpiperidine-2-carboxylate Traditional Name: 1-(4-acetylphenyl)sulfonylpipecolinic acid 2-(2,6-dimethylphenoxy)ethyl ester Formula: C24H29NO6S MolecularWeight: 459.55516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OCCOC(=O)C2CCCCN2S(=O)(=O)C3=CC=C(C=C3)C(=O)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)OCCOC(=O)C2CCCCN2S(=O)(=O)C3=CC=C(C=C3)C(=O)C

InChI

InChI=1S/C24H29NO6S/c1-17-7-6-8-18(2)23(17)30-15-16-31-24(27)22-9-4-5-14-25(22)32(28,29)21-12-10-20(11-13-21)19(3)26/h6-8,10-13,22H,4-5,9,14-16H2,1-3H3