ethyl 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)propanoate

Systemtic Name: ethyl 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)propanoate Openeye Name: ethyl 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)propanoate CAS Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)propanoic acid ethyl ester IUPAC Name: ethyl 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)propanoate Traditional Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)propionic acid ethyl ester Formula: C14H18O4S MolecularWeight: 282.35532

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCSC1=CC2=C(C=C1)OCCCO2

Isomeric SMILES

CCOC(=O)CCSC1=CC2=C(C=C1)OCCCO2

InChI

InChI=1S/C14H18O4S/c1-2-16-14(15)6-9-19-11-4-5-12-13(10-11)18-8-3-7-17-12/h4-5,10H,2-3,6-9H2,1H3