(3-methylphenyl)methyl 1-(4-ethanoylphenyl)sulfonylpiperidine-2-carboxylate

Systemtic Name: (3-methylphenyl)methyl 1-(4-ethanoylphenyl)sulfonylpiperidine-2-carboxylate Openeye Name: m-tolylmethyl 1-(4-acetylphenyl)sulfonylpiperidine-2-carboxylate CAS Name: 1-(4-acetylphenyl)sulfonyl-2-piperidinecarboxylic acid (3-methylphenyl)methyl ester IUPAC Name: (3-methylphenyl)methyl 1-(4-acetylphenyl)sulfonylpiperidine-2-carboxylate Traditional Name: 1-(4-acetylphenyl)sulfonylpipecolinic acid (3-methylbenzyl) ester Formula: C22H25NO5S MolecularWeight: 415.5026

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25NO5S/c1-16-6-5-7-18(14-16)15-28-22(25)21-8-3-4-13-23(21)29(26,27)20-11-9-19(10-12-20)17(2)24/h5-7,9-12,14,21H,3-4,8,13,15H2,1-2H3