(2,6-dimethylphenyl) 4-(3,5-dimethylpiperidin-1-yl)sulfonylbenzoate

Systemtic Name: (2,6-dimethylphenyl) 4-(3,5-dimethylpiperidin-1-yl)sulfonylbenzoate Openeye Name: (2,6-dimethylphenyl) 4-[(3,5-dimethyl-1-piperidyl)sulfonyl]benzoate CAS Name: 4-[(3,5-dimethyl-1-piperidinyl)sulfonyl]benzoic acid (2,6-dimethylphenyl) ester IUPAC Name: (2,6-dimethylphenyl) 4-(3,5-dimethylpiperidin-1-yl)sulfonylbenzoate Traditional Name: 4-(3,5-dimethylpiperidino)sulfonylbenzoic acid (2,6-dimethylphenyl) ester Formula: C22H27NO4S MolecularWeight: 401.51908

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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=CC=C3C)C)C

Isomeric SMILES

CC1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OC3=C(C=CC=C3C)C)C

InChI

InChI=1S/C22H27NO4S/c1-15-12-16(2)14-23(13-15)28(25,26)20-10-8-19(9-11-20)22(24)27-21-17(3)6-5-7-18(21)4/h5-11,15-16H,12-14H2,1-4H3