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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1COC(=O)C2CCCCN2S(=O)(=O)C3=CC=C(C=C3)C(=O)C

Isomeric SMILES

CC1=CC=CC=C1COC(=O)C2CCCCN2S(=O)(=O)C3=CC=C(C=C3)C(=O)C

InChI

InChI=1S/C22H25NO5S/c1-16-7-3-4-8-19(16)15-28-22(25)21-9-5-6-14-23(21)29(26,27)20-12-10-18(11-13-20)17(2)24/h3-4,7-8,10-13,21H,5-6,9,14-15H2,1-2H3