N-[2-(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)ethyl]-3-methylsulfanyl-propanamide

Systemtic Name: N-[2-(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)ethyl]-3-methylsulfanyl-propanamide Openeye Name: N-[2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)ethyl]-3-methylsulfanyl-propanamide CAS Name: N-[2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)ethyl]-3-(methylthio)propanamide IUPAC Name: N-[2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)ethyl]-3-methylsulfanylpropanamide Traditional Name: N-[2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)ethyl]-3-(methylthio)propionamide Formula: C14H18ClNO3S MolecularWeight: 315.81562

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(=O)NCCC1=CC2=C(C(=C1)Cl)OCCO2

Isomeric SMILES

CSCCC(=O)NCCC1=CC2=C(C(=C1)Cl)OCCO2

InChI

InChI=1S/C14H18ClNO3S/c1-20-7-3-13(17)16-4-2-10-8-11(15)14-12(9-10)18-5-6-19-14/h8-9H,2-7H2,1H3,(H,16,17)