1-(2-chlorophenyl)-3-(5-ethyl-3,3-dimethyl-4-oxidanylidene-2H-1,5-benzoxazepin-8-yl)urea

Systemtic Name: 1-(2-chlorophenyl)-3-(5-ethyl-3,3-dimethyl-4-oxidanylidene-2H-1,5-benzoxazepin-8-yl)urea Openeye Name: 1-(2-chlorophenyl)-3-(5-ethyl-3,3-dimethyl-4-oxo-2H-1,5-benzoxazepin-8-yl)urea CAS Name: 1-(2-chlorophenyl)-3-(5-ethyl-3,3-dimethyl-4-oxo-2H-1,5-benzoxazepin-8-yl)urea IUPAC Name: 1-(2-chlorophenyl)-3-(5-ethyl-3,3-dimethyl-4-oxo-2H-1,5-benzoxazepin-8-yl)urea Traditional Name: 1-(2-chlorophenyl)-3-(5-ethyl-4-keto-3,3-dimethyl-2H-1,5-benzoxazepin-8-yl)urea Formula: C20H22ClN3O3 MolecularWeight: 387.85998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)NC(=O)NC3=CC=CC=C3Cl)OCC(C1=O)(C)C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)NC(=O)NC3=CC=CC=C3Cl)OCC(C1=O)(C)C

InChI

InChI=1S/C20H22ClN3O3/c1-4-24-16-10-9-13(11-17(16)27-12-20(2,3)18(24)25)22-19(26)23-15-8-6-5-7-14(15)21/h5-11H,4,12H2,1-3H3,(H2,22,23,26)