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

Systemtic Name: N-(3,5-dimethyl-6-oxidanylidene-benzo[b][1,4]benzoxazepin-8-yl)-3,4-diethoxy-benzamide Openeye Name: N-(3,5-dimethyl-6-oxo-benzo[b][1,4]benzoxazepin-8-yl)-3,4-diethoxy-benzamide CAS Name: N-(3,5-dimethyl-6-oxo-8-benzo[b][1,4]benzoxazepinyl)-3,4-diethoxybenzamide IUPAC Name: N-(3,5-dimethyl-6-oxobenzo[b][1,4]benzoxazepin-8-yl)-3,4-diethoxybenzamide Traditional Name: 3,4-diethoxy-N-(6-keto-3,5-dimethyl-benzo[b][1,4]benzoxazepin-8-yl)benzamide Formula: C26H26N2O5 MolecularWeight: 446.49504

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)OC4=C(C=C(C=C4)C)N(C3=O)C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)OC4=C(C=C(C=C4)C)N(C3=O)C)OCC

InChI

InChI=1S/C26H26N2O5/c1-5-31-23-11-8-17(14-24(23)32-6-2)25(29)27-18-9-12-21-19(15-18)26(30)28(4)20-13-16(3)7-10-22(20)33-21/h7-15H,5-6H2,1-4H3,(H,27,29)