N-[(2,5-dimethoxyphenyl)methyl]-2-methylsulfonyl-propanamide

Systemtic Name: N-[(2,5-dimethoxyphenyl)methyl]-2-methylsulfonyl-propanamide Openeye Name: N-[(2,5-dimethoxyphenyl)methyl]-2-methylsulfonyl-propanamide CAS Name: N-[(2,5-dimethoxyphenyl)methyl]-2-methylsulfonylpropanamide IUPAC Name: N-[(2,5-dimethoxyphenyl)methyl]-2-methylsulfonylpropanamide Traditional Name: N-(2,5-dimethoxybenzyl)-2-mesyl-propionamide Formula: C13H19NO5S MolecularWeight: 301.35866

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=C(C=CC(=C1)OC)OC)S(=O)(=O)C

Isomeric SMILES

CC(C(=O)NCC1=C(C=CC(=C1)OC)OC)S(=O)(=O)C

InChI

InChI=1S/C13H19NO5S/c1-9(20(4,16)17)13(15)14-8-10-7-11(18-2)5-6-12(10)19-3/h5-7,9H,8H2,1-4H3,(H,14,15)