N-(5-ethyl-3,3-dimethyl-4-oxidanylidene-2H-1,5-benzoxazepin-8-yl)-4-phenyl-oxane-4-carboxamide

Systemtic Name: N-(5-ethyl-3,3-dimethyl-4-oxidanylidene-2H-1,5-benzoxazepin-8-yl)-4-phenyl-oxane-4-carboxamide Openeye Name: N-(5-ethyl-3,3-dimethyl-4-oxo-2H-1,5-benzoxazepin-8-yl)-4-phenyl-tetrahydropyran-4-carboxamide CAS Name: N-(5-ethyl-3,3-dimethyl-4-oxo-2H-1,5-benzoxazepin-8-yl)-4-phenyl-4-oxanecarboxamide IUPAC Name: N-(5-ethyl-3,3-dimethyl-4-oxo-2H-1,5-benzoxazepin-8-yl)-4-phenyloxane-4-carboxamide Traditional Name: N-(5-ethyl-4-keto-3,3-dimethyl-2H-1,5-benzoxazepin-8-yl)-4-phenyl-tetrahydropyran-4-carboxamide Formula: C25H30N2O4 MolecularWeight: 422.5167

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)NC(=O)C3(CCOCC3)C4=CC=CC=C4)OCC(C1=O)(C)C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)NC(=O)C3(CCOCC3)C4=CC=CC=C4)OCC(C1=O)(C)C

InChI

InChI=1S/C25H30N2O4/c1-4-27-20-11-10-19(16-21(20)31-17-24(2,3)23(27)29)26-22(28)25(12-14-30-15-13-25)18-8-6-5-7-9-18/h5-11,16H,4,12-15,17H2,1-3H3,(H,26,28)