N-(3,5-dimethyl-6-oxidanylidene-benzo[b][1,4]benzoxazepin-8-yl)-4-phenyl-oxane-4-carboxamide

Systemtic Name: N-(3,5-dimethyl-6-oxidanylidene-benzo[b][1,4]benzoxazepin-8-yl)-4-phenyl-oxane-4-carboxamide Openeye Name: N-(3,5-dimethyl-6-oxo-benzo[b][1,4]benzoxazepin-8-yl)-4-phenyl-tetrahydropyran-4-carboxamide CAS Name: N-(3,5-dimethyl-6-oxo-8-benzo[b][1,4]benzoxazepinyl)-4-phenyl-4-oxanecarboxamide IUPAC Name: N-(3,5-dimethyl-6-oxobenzo[b][1,4]benzoxazepin-8-yl)-4-phenyloxane-4-carboxamide Traditional Name: N-(6-keto-3,5-dimethyl-benzo[b][1,4]benzoxazepin-8-yl)-4-phenyl-tetrahydropyran-4-carboxamide Formula: C27H26N2O4 MolecularWeight: 442.50634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC3=C(C=C(C=C3)NC(=O)C4(CCOCC4)C5=CC=CC=C5)C(=O)N2C

Isomeric SMILES

CC1=CC2=C(C=C1)OC3=C(C=C(C=C3)NC(=O)C4(CCOCC4)C5=CC=CC=C5)C(=O)N2C

InChI

InChI=1S/C27H26N2O4/c1-18-8-10-24-22(16-18)29(2)25(30)21-17-20(9-11-23(21)33-24)28-26(31)27(12-14-32-15-13-27)19-6-4-3-5-7-19/h3-11,16-17H,12-15H2,1-2H3,(H,28,31)