1-(1,3-benzodioxol-5-yl)-3-(5-methyl-6-oxidanylidene-benzo[b][1,4]benzoxazepin-8-yl)urea

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-(5-methyl-6-oxidanylidene-benzo[b][1,4]benzoxazepin-8-yl)urea Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-(5-methyl-6-oxo-benzo[b][1,4]benzoxazepin-8-yl)urea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-(5-methyl-6-oxo-8-benzo[b][1,4]benzoxazepinyl)urea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-(5-methyl-6-oxobenzo[b][1,4]benzoxazepin-8-yl)urea Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-(6-keto-5-methyl-benzo[b][1,4]benzoxazepin-8-yl)urea Formula: C22H17N3O5 MolecularWeight: 403.38748

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2OC3=C(C1=O)C=C(C=C3)NC(=O)NC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CN1C2=CC=CC=C2OC3=C(C1=O)C=C(C=C3)NC(=O)NC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H17N3O5/c1-25-16-4-2-3-5-18(16)30-17-8-6-13(10-15(17)21(25)26)23-22(27)24-14-7-9-19-20(11-14)29-12-28-19/h2-11H,12H2,1H3,(H2,23,24,27)