(2,5-dimethylphenyl)methyl 1-(4-ethanoylphenyl)sulfonylpiperidine-2-carboxylate

Systemtic Name: (2,5-dimethylphenyl)methyl 1-(4-ethanoylphenyl)sulfonylpiperidine-2-carboxylate Openeye Name: (2,5-dimethylphenyl)methyl 1-(4-acetylphenyl)sulfonylpiperidine-2-carboxylate CAS Name: 1-(4-acetylphenyl)sulfonyl-2-piperidinecarboxylic acid (2,5-dimethylphenyl)methyl ester IUPAC Name: (2,5-dimethylphenyl)methyl 1-(4-acetylphenyl)sulfonylpiperidine-2-carboxylate Traditional Name: 1-(4-acetylphenyl)sulfonylpipecolinic acid (2,5-dimethylbenzyl) ester Formula: C23H27NO5S MolecularWeight: 429.52918

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27NO5S/c1-16-7-8-17(2)20(14-16)15-29-23(26)22-6-4-5-13-24(22)30(27,28)21-11-9-19(10-12-21)18(3)25/h7-12,14,22H,4-6,13,15H2,1-3H3