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

Systemtic Name: 4-(pentanoylamino)-3,4-dihydro-2H-chromene-6-sulfonyl chloride Openeye Name: 4-(pentanoylamino)chromane-6-sulfonyl chloride CAS Name: 4-(1-oxopentylamino)-3,4-dihydro-2H-1-benzopyran-6-sulfonyl chloride IUPAC Name: 4-(pentanoylamino)-3,4-dihydro-2H-chromene-6-sulfonyl chloride Traditional Name: 4-(valerylamino)chroman-6-sulfonyl chloride Formula: C14H18ClNO4S MolecularWeight: 331.81502

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18ClNO4S/c1-2-3-4-14(17)16-12-7-8-20-13-6-5-10(9-11(12)13)21(15,18)19/h5-6,9,12H,2-4,7-8H2,1H3,(H,16,17)