N-[2-(3,4-dimethoxyphenyl)-4-methylsulfonyl-butyl]-N-methyl-benzamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)-4-methylsulfonyl-butyl]-N-methyl-benzamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)-4-methylsulfonyl-butyl]-N-methyl-benzamide CAS Name: N-[2-(3,4-dimethoxyphenyl)-4-methylsulfonylbutyl]-N-methylbenzamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)-4-methylsulfonylbutyl]-N-methylbenzamide Traditional Name: N-[2-(3,4-dimethoxyphenyl)-4-mesyl-butyl]-N-methyl-benzamide Formula: C21H27NO5S MolecularWeight: 405.50778

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(CCS(=O)(=O)C)C1=CC(=C(C=C1)OC)OC)C(=O)C2=CC=CC=C2

Isomeric SMILES

CN(CC(CCS(=O)(=O)C)C1=CC(=C(C=C1)OC)OC)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C21H27NO5S/c1-22(21(23)16-8-6-5-7-9-16)15-18(12-13-28(4,24)25)17-10-11-19(26-2)20(14-17)27-3/h5-11,14,18H,12-13,15H2,1-4H3