6-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)ethanoyl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)ethanoyl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)acetyl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)-1-oxoethyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)acetyl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)acetyl]-4H-1,4-benzoxazin-3-one Formula: C19H17NO5S MolecularWeight: 371.40698

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)SCC(=O)C3=CC4=C(C=C3)OCC(=O)N4)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)SCC(=O)C3=CC4=C(C=C3)OCC(=O)N4)OC1

InChI

InChI=1S/C19H17NO5S/c21-15(12-2-4-16-14(8-12)20-19(22)10-25-16)11-26-13-3-5-17-18(9-13)24-7-1-6-23-17/h2-5,8-9H,1,6-7,10-11H2,(H,20,22)