2-azanyl-N-(6-chloranyl-1,3-benzodioxol-5-yl)-4-methylsulfonyl-butanamide

Systemtic Name: 2-azanyl-N-(6-chloranyl-1,3-benzodioxol-5-yl)-4-methylsulfonyl-butanamide Openeye Name: 2-amino-N-(6-chloro-1,3-benzodioxol-5-yl)-4-methylsulfonyl-butanamide CAS Name: 2-amino-N-(6-chloro-1,3-benzodioxol-5-yl)-4-methylsulfonylbutanamide IUPAC Name: 2-amino-N-(6-chloro-1,3-benzodioxol-5-yl)-4-methylsulfonylbutanamide Traditional Name: 2-amino-N-(6-chloro-1,3-benzodioxol-5-yl)-4-mesyl-butyramide Formula: C12H15ClN2O5S MolecularWeight: 334.7759

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCC(C(=O)NC1=CC2=C(C=C1Cl)OCO2)N

Isomeric SMILES

CS(=O)(=O)CCC(C(=O)NC1=CC2=C(C=C1Cl)OCO2)N

InChI

InChI=1S/C12H15ClN2O5S/c1-21(17,18)3-2-8(14)12(16)15-9-5-11-10(4-7(9)13)19-6-20-11/h4-5,8H,2-3,6,14H2,1H3,(H,15,16)