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

Systemtic Name: 4-(butanoylamino)-3,4-dihydro-2H-chromene-6-sulfonyl chloride Openeye Name: 4-(butanoylamino)chromane-6-sulfonyl chloride CAS Name: 4-(1-oxobutylamino)-3,4-dihydro-2H-1-benzopyran-6-sulfonyl chloride IUPAC Name: 4-(butanoylamino)-3,4-dihydro-2H-chromene-6-sulfonyl chloride Traditional Name: 4-butyramidochroman-6-sulfonyl chloride Formula: C13H16ClNO4S MolecularWeight: 317.78844

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16ClNO4S/c1-2-3-13(16)15-11-6-7-19-12-5-4-9(8-10(11)12)20(14,17)18/h4-5,8,11H,2-3,6-7H2,1H3,(H,15,16)