[2-(4-methylpiperidin-1-yl)-2-oxidanylidene-ethyl] 2-(2,5-dimethylphenyl)sulfonyloxybenzoate

Systemtic Name: [2-(4-methylpiperidin-1-yl)-2-oxidanylidene-ethyl] 2-(2,5-dimethylphenyl)sulfonyloxybenzoate Openeye Name: [2-(4-methyl-1-piperidyl)-2-oxo-ethyl] 2-(2,5-dimethylphenyl)sulfonyloxybenzoate CAS Name: 2-(2,5-dimethylphenyl)sulfonyloxybenzoic acid [2-(4-methyl-1-piperidinyl)-2-oxoethyl] ester IUPAC Name: [2-(4-methylpiperidin-1-yl)-2-oxoethyl] 2-(2,5-dimethylphenyl)sulfonyloxybenzoate Traditional Name: 2-(2,5-dimethylphenyl)sulfonyloxybenzoic acid [2-keto-2-(4-methylpiperidino)ethyl] ester Formula: C23H27NO6S MolecularWeight: 445.52858

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)COC(=O)C2=CC=CC=C2OS(=O)(=O)C3=C(C=CC(=C3)C)C

Isomeric SMILES

CC1CCN(CC1)C(=O)COC(=O)C2=CC=CC=C2OS(=O)(=O)C3=C(C=CC(=C3)C)C

InChI

InChI=1S/C23H27NO6S/c1-16-10-12-24(13-11-16)22(25)15-29-23(26)19-6-4-5-7-20(19)30-31(27,28)21-14-17(2)8-9-18(21)3/h4-9,14,16H,10-13,15H2,1-3H3