2-azanyl-N-(3,4-dimethoxyphenyl)-4-methylsulfonyl-butanamide

Systemtic Name: 2-azanyl-N-(3,4-dimethoxyphenyl)-4-methylsulfonyl-butanamide Openeye Name: 2-amino-N-(3,4-dimethoxyphenyl)-4-methylsulfonyl-butanamide CAS Name: 2-amino-N-(3,4-dimethoxyphenyl)-4-methylsulfonylbutanamide IUPAC Name: 2-amino-N-(3,4-dimethoxyphenyl)-4-methylsulfonylbutanamide Traditional Name: 2-amino-N-(3,4-dimethoxyphenyl)-4-mesyl-butyramide Formula: C13H20N2O5S MolecularWeight: 316.3733

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C(CCS(=O)(=O)C)N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C(CCS(=O)(=O)C)N)OC

InChI

InChI=1S/C13H20N2O5S/c1-19-11-5-4-9(8-12(11)20-2)15-13(16)10(14)6-7-21(3,17)18/h4-5,8,10H,6-7,14H2,1-3H3,(H,15,16)