N-(1,3-benzodioxol-5-yl)-2-[(3-chlorophenyl)-methylsulfonyl-amino]propanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-[(3-chlorophenyl)-methylsulfonyl-amino]propanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-(3-chloro-N-methylsulfonyl-anilino)propanamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-(3-chloro-N-methylsulfonylanilino)propanamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-(3-chloro-N-methylsulfonylanilino)propanamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-(3-chloro-N-mesyl-anilino)propionamide Formula: C17H17ClN2O5S MolecularWeight: 396.84528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=C(C=C1)OCO2)N(C3=CC(=CC=C3)Cl)S(=O)(=O)C

Isomeric SMILES

CC(C(=O)NC1=CC2=C(C=C1)OCO2)N(C3=CC(=CC=C3)Cl)S(=O)(=O)C

InChI

InChI=1S/C17H17ClN2O5S/c1-11(20(26(2,22)23)14-5-3-4-12(18)8-14)17(21)19-13-6-7-15-16(9-13)25-10-24-15/h3-9,11H,10H2,1-2H3,(H,19,21)