2-(4-chloranylphenoxy)-N-(5-ethyl-6-oxidanylidene-benzo[b][1,4]benzoxazepin-8-yl)-2-methyl-propanamide

Systemtic Name: 2-(4-chloranylphenoxy)-N-(5-ethyl-6-oxidanylidene-benzo[b][1,4]benzoxazepin-8-yl)-2-methyl-propanamide Openeye Name: 2-(4-chlorophenoxy)-N-(5-ethyl-6-oxo-benzo[b][1,4]benzoxazepin-8-yl)-2-methyl-propanamide CAS Name: 2-(4-chlorophenoxy)-N-(5-ethyl-6-oxo-8-benzo[b][1,4]benzoxazepinyl)-2-methylpropanamide IUPAC Name: 2-(4-chlorophenoxy)-N-(5-ethyl-6-oxobenzo[b][1,4]benzoxazepin-8-yl)-2-methylpropanamide Traditional Name: 2-(4-chlorophenoxy)-N-(5-ethyl-6-keto-benzo[b][1,4]benzoxazepin-8-yl)-2-methyl-propionamide Formula: C25H23ClN2O4 MolecularWeight: 450.91412

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2OC3=C(C1=O)C=C(C=C3)NC(=O)C(C)(C)OC4=CC=C(C=C4)Cl

Isomeric SMILES

CCN1C2=CC=CC=C2OC3=C(C1=O)C=C(C=C3)NC(=O)C(C)(C)OC4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H23ClN2O4/c1-4-28-20-7-5-6-8-22(20)31-21-14-11-17(15-19(21)23(28)29)27-24(30)25(2,3)32-18-12-9-16(26)10-13-18/h5-15H,4H2,1-3H3,(H,27,30)