3-[(E)-4-(1,3-benzodioxol-5-yl)-2-oxidanylidene-but-3-enyl]-1,4-benzoxazin-2-one

Systemtic Name: 3-[(E)-4-(1,3-benzodioxol-5-yl)-2-oxidanylidene-but-3-enyl]-1,4-benzoxazin-2-one Openeye Name: 3-[(E)-4-(1,3-benzodioxol-5-yl)-2-oxo-but-3-enyl]-1,4-benzoxazin-2-one CAS Name: 3-[(E)-4-(1,3-benzodioxol-5-yl)-2-oxobut-3-enyl]-1,4-benzoxazin-2-one IUPAC Name: 3-[(E)-4-(1,3-benzodioxol-5-yl)-2-oxobut-3-enyl]-1,4-benzoxazin-2-one Traditional Name: 3-[(E)-4-(1,3-benzodioxol-5-yl)-2-keto-but-3-enyl]-1,4-benzoxazin-2-one Formula: C19H13NO5 MolecularWeight: 335.31022

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=CC(=O)CC3=NC4=CC=CC=C4OC3=O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=C/C(=O)CC3=NC4=CC=CC=C4OC3=O

InChI

InChI=1S/C19H13NO5/c21-13(7-5-12-6-8-17-18(9-12)24-11-23-17)10-15-19(22)25-16-4-2-1-3-14(16)20-15/h1-9H,10-11H2/b7-5+