2-chloranylprop-2-enyl (2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-3-methyl-butanoate

Systemtic Name: 2-chloranylprop-2-enyl (2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-3-methyl-butanoate Openeye Name: 2-chloroallyl (2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-3-methyl-butanoate CAS Name: (2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-3-methylbutanoic acid 2-chloroprop-2-enyl ester IUPAC Name: 2-chloroprop-2-enyl (2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-3-methylbutanoate Traditional Name: (2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-3-methyl-butyric acid 2-chloroallyl ester Formula: C16H20ClNO6S MolecularWeight: 389.8511

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC(=C)Cl)NS(=O)(=O)C1=CC2=C(C=C1)OCCO2

Isomeric SMILES

CC(C)[C@@H](C(=O)OCC(=C)Cl)NS(=O)(=O)C1=CC2=C(C=C1)OCCO2

InChI

InChI=1S/C16H20ClNO6S/c1-10(2)15(16(19)24-9-11(3)17)18-25(20,21)12-4-5-13-14(8-12)23-7-6-22-13/h4-5,8,10,15,18H,3,6-7,9H2,1-2H3/t15-/m0/s1