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

Systemtic Name: N-(3,5-dimethyl-6-oxidanylidene-benzo[b][1,4]benzoxazepin-8-yl)adamantane-1-carboxamide Openeye Name: N-(3,5-dimethyl-6-oxo-benzo[b][1,4]benzoxazepin-8-yl)adamantane-1-carboxamide CAS Name: N-(3,5-dimethyl-6-oxo-8-benzo[b][1,4]benzoxazepinyl)-1-adamantanecarboxamide IUPAC Name: N-(3,5-dimethyl-6-oxobenzo[b][1,4]benzoxazepin-8-yl)adamantane-1-carboxamide Traditional Name: N-(6-keto-3,5-dimethyl-benzo[b][1,4]benzoxazepin-8-yl)adamantane-1-carboxamide Formula: C26H28N2O3 MolecularWeight: 416.51212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC3=C(C=C(C=C3)NC(=O)C45CC6CC(C4)CC(C6)C5)C(=O)N2C

Isomeric SMILES

CC1=CC2=C(C=C1)OC3=C(C=C(C=C3)NC(=O)C45CC6CC(C4)CC(C6)C5)C(=O)N2C

InChI

InChI=1S/C26H28N2O3/c1-15-3-5-23-21(7-15)28(2)24(29)20-11-19(4-6-22(20)31-23)27-25(30)26-12-16-8-17(13-26)10-18(9-16)14-26/h3-7,11,16-18H,8-10,12-14H2,1-2H3,(H,27,30)