(2,6-dimethoxyphenyl) 2-methyl-5-piperidin-1-ylsulfonyl-benzoate

Systemtic Name: (2,6-dimethoxyphenyl) 2-methyl-5-piperidin-1-ylsulfonyl-benzoate Openeye Name: (2,6-dimethoxyphenyl) 2-methyl-5-(1-piperidylsulfonyl)benzoate CAS Name: 2-methyl-5-(1-piperidinylsulfonyl)benzoic acid (2,6-dimethoxyphenyl) ester IUPAC Name: (2,6-dimethoxyphenyl) 2-methyl-5-piperidin-1-ylsulfonylbenzoate Traditional Name: 2-methyl-5-piperidinosulfonyl-benzoic acid (2,6-dimethoxyphenyl) ester Formula: C21H25NO6S MolecularWeight: 419.4913

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)OC3=C(C=CC=C3OC)OC

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)OC3=C(C=CC=C3OC)OC

InChI

InChI=1S/C21H25NO6S/c1-15-10-11-16(29(24,25)22-12-5-4-6-13-22)14-17(15)21(23)28-20-18(26-2)8-7-9-19(20)27-3/h7-11,14H,4-6,12-13H2,1-3H3