(3,4-dichlorophenyl)methyl 3-(3,5-dimethylpiperidin-1-yl)sulfonylbenzoate

Systemtic Name: (3,4-dichlorophenyl)methyl 3-(3,5-dimethylpiperidin-1-yl)sulfonylbenzoate Openeye Name: (3,4-dichlorophenyl)methyl 3-[(3,5-dimethyl-1-piperidyl)sulfonyl]benzoate CAS Name: 3-[(3,5-dimethyl-1-piperidinyl)sulfonyl]benzoic acid (3,4-dichlorophenyl)methyl ester IUPAC Name: (3,4-dichlorophenyl)methyl 3-(3,5-dimethylpiperidin-1-yl)sulfonylbenzoate Traditional Name: 3-(3,5-dimethylpiperidino)sulfonylbenzoic acid (3,4-dichlorobenzyl) ester Formula: C21H23Cl2NO4S MolecularWeight: 456.38262

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)OCC3=CC(=C(C=C3)Cl)Cl)C

Isomeric SMILES

CC1CC(CN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)OCC3=CC(=C(C=C3)Cl)Cl)C

InChI

InChI=1S/C21H23Cl2NO4S/c1-14-8-15(2)12-24(11-14)29(26,27)18-5-3-4-17(10-18)21(25)28-13-16-6-7-19(22)20(23)9-16/h3-7,9-10,14-15H,8,11-13H2,1-2H3