N-[3,3-dimethyl-5-(3-methylbutyl)-4-oxidanylidene-2H-1,5-benzoxazepin-8-yl]-7-methoxy-1-benzofuran-2-carboxamide

Systemtic Name: N-[3,3-dimethyl-5-(3-methylbutyl)-4-oxidanylidene-2H-1,5-benzoxazepin-8-yl]-7-methoxy-1-benzofuran-2-carboxamide Openeye Name: N-(5-isopentyl-3,3-dimethyl-4-oxo-2H-1,5-benzoxazepin-8-yl)-7-methoxy-benzofuran-2-carboxamide CAS Name: N-[3,3-dimethyl-5-(3-methylbutyl)-4-oxo-2H-1,5-benzoxazepin-8-yl]-7-methoxy-2-benzofurancarboxamide IUPAC Name: N-[3,3-dimethyl-5-(3-methylbutyl)-4-oxo-2H-1,5-benzoxazepin-8-yl]-7-methoxy-1-benzofuran-2-carboxamide Traditional Name: N-(5-isoamyl-4-keto-3,3-dimethyl-2H-1,5-benzoxazepin-8-yl)-7-methoxy-coumarilamide Formula: C26H30N2O5 MolecularWeight: 450.5268

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C2=C(C=C(C=C2)NC(=O)C3=CC4=C(O3)C(=CC=C4)OC)OCC(C1=O)(C)C

Isomeric SMILES

CC(C)CCN1C2=C(C=C(C=C2)NC(=O)C3=CC4=C(O3)C(=CC=C4)OC)OCC(C1=O)(C)C

InChI

InChI=1S/C26H30N2O5/c1-16(2)11-12-28-19-10-9-18(14-21(19)32-15-26(3,4)25(28)30)27-24(29)22-13-17-7-6-8-20(31-5)23(17)33-22/h6-10,13-14,16H,11-12,15H2,1-5H3,(H,27,29)