6-[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)propanoyl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)propanoyl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)propanoyl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-1-oxopropyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)propanoyl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)propanoyl]-4H-1,4-benzoxazin-3-one Formula: C19H17NO5S MolecularWeight: 371.40698

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC2=C(C=C1)OCC(=O)N2)SC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C[C@@H](C(=O)C1=CC2=C(C=C1)OCC(=O)N2)SC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C19H17NO5S/c1-11(26-13-3-5-16-17(9-13)24-7-6-23-16)19(22)12-2-4-15-14(8-12)20-18(21)10-25-15/h2-5,8-9,11H,6-7,10H2,1H3,(H,20,21)/t11-/m0/s1