1-(5-chloranyl-2-methoxy-phenyl)-3-(5-ethyl-3,3-dimethyl-4-oxidanylidene-2H-1,5-benzoxazepin-7-yl)urea

Systemtic Name: 1-(5-chloranyl-2-methoxy-phenyl)-3-(5-ethyl-3,3-dimethyl-4-oxidanylidene-2H-1,5-benzoxazepin-7-yl)urea Openeye Name: 1-(5-chloro-2-methoxy-phenyl)-3-(5-ethyl-3,3-dimethyl-4-oxo-2H-1,5-benzoxazepin-7-yl)urea CAS Name: 1-(5-chloro-2-methoxyphenyl)-3-(5-ethyl-3,3-dimethyl-4-oxo-2H-1,5-benzoxazepin-7-yl)urea IUPAC Name: 1-(5-chloro-2-methoxyphenyl)-3-(5-ethyl-3,3-dimethyl-4-oxo-2H-1,5-benzoxazepin-7-yl)urea Traditional Name: 1-(5-chloro-2-methoxy-phenyl)-3-(5-ethyl-4-keto-3,3-dimethyl-2H-1,5-benzoxazepin-7-yl)urea Formula: C21H24ClN3O4 MolecularWeight: 417.88596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=CC(=C2)NC(=O)NC3=C(C=CC(=C3)Cl)OC)OCC(C1=O)(C)C

Isomeric SMILES

CCN1C2=C(C=CC(=C2)NC(=O)NC3=C(C=CC(=C3)Cl)OC)OCC(C1=O)(C)C

InChI

InChI=1S/C21H24ClN3O4/c1-5-25-16-11-14(7-9-18(16)29-12-21(2,3)19(25)26)23-20(27)24-15-10-13(22)6-8-17(15)28-4/h6-11H,5,12H2,1-4H3,(H2,23,24,27)