(4-chloranyl-2-methyl-phenyl) 4-(3,5-dimethylpiperidin-1-yl)sulfonylbenzoate

Systemtic Name: (4-chloranyl-2-methyl-phenyl) 4-(3,5-dimethylpiperidin-1-yl)sulfonylbenzoate Openeye Name: (4-chloro-2-methyl-phenyl) 4-[(3,5-dimethyl-1-piperidyl)sulfonyl]benzoate CAS Name: 4-[(3,5-dimethyl-1-piperidinyl)sulfonyl]benzoic acid (4-chloro-2-methylphenyl) ester IUPAC Name: (4-chloro-2-methylphenyl) 4-(3,5-dimethylpiperidin-1-yl)sulfonylbenzoate Traditional Name: 4-(3,5-dimethylpiperidino)sulfonylbenzoic acid (4-chloro-2-methyl-phenyl) ester Formula: C21H24ClNO4S MolecularWeight: 421.93756

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OC3=C(C=C(C=C3)Cl)C)C

Isomeric SMILES

CC1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OC3=C(C=C(C=C3)Cl)C)C

InChI

InChI=1S/C21H24ClNO4S/c1-14-10-15(2)13-23(12-14)28(25,26)19-7-4-17(5-8-19)21(24)27-20-9-6-18(22)11-16(20)3/h4-9,11,14-15H,10,12-13H2,1-3H3