4-(2-methylpropanoylamino)-3,4-dihydro-2H-chromene-6-sulfonyl chloride

Systemtic Name: 4-(2-methylpropanoylamino)-3,4-dihydro-2H-chromene-6-sulfonyl chloride Openeye Name: 4-(2-methylpropanoylamino)chromane-6-sulfonyl chloride CAS Name: 4-[(2-methyl-1-oxopropyl)amino]-3,4-dihydro-2H-1-benzopyran-6-sulfonyl chloride IUPAC Name: 4-(2-methylpropanoylamino)-3,4-dihydro-2H-chromene-6-sulfonyl chloride Traditional Name: 4-(isobutyrylamino)chroman-6-sulfonyl chloride Formula: C13H16ClNO4S MolecularWeight: 317.78844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1CCOC2=C1C=C(C=C2)S(=O)(=O)Cl

Isomeric SMILES

CC(C)C(=O)NC1CCOC2=C1C=C(C=C2)S(=O)(=O)Cl

InChI

InChI=1S/C13H16ClNO4S/c1-8(2)13(16)15-11-5-6-19-12-4-3-9(7-10(11)12)20(14,17)18/h3-4,7-8,11H,5-6H2,1-2H3,(H,15,16)