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

Systemtic Name: 1-(4-ethoxyphenyl)-3-(5-ethyl-3,3-dimethyl-4-oxidanylidene-2H-1,5-benzoxazepin-8-yl)urea Openeye Name: 1-(4-ethoxyphenyl)-3-(5-ethyl-3,3-dimethyl-4-oxo-2H-1,5-benzoxazepin-8-yl)urea CAS Name: 1-(4-ethoxyphenyl)-3-(5-ethyl-3,3-dimethyl-4-oxo-2H-1,5-benzoxazepin-8-yl)urea IUPAC Name: 1-(4-ethoxyphenyl)-3-(5-ethyl-3,3-dimethyl-4-oxo-2H-1,5-benzoxazepin-8-yl)urea Traditional Name: 1-(5-ethyl-4-keto-3,3-dimethyl-2H-1,5-benzoxazepin-8-yl)-3-p-phenetyl-urea Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O4/c1-5-25-18-12-9-16(13-19(18)29-14-22(3,4)20(25)26)24-21(27)23-15-7-10-17(11-8-15)28-6-2/h7-13H,5-6,14H2,1-4H3,(H2,23,24,27)