N-[3,3-dimethyl-5-(3-methylbutyl)-4-oxidanylidene-2H-1,5-benzoxazepin-8-yl]-2-methyl-2,3-dihydro-1,4-benzodioxine-3-carboxamide

Systemtic Name: N-[3,3-dimethyl-5-(3-methylbutyl)-4-oxidanylidene-2H-1,5-benzoxazepin-8-yl]-2-methyl-2,3-dihydro-1,4-benzodioxine-3-carboxamide Openeye Name: N-(5-isopentyl-3,3-dimethyl-4-oxo-2H-1,5-benzoxazepin-8-yl)-2-methyl-2,3-dihydro-1,4-benzodioxine-3-carboxamide CAS Name: N-[3,3-dimethyl-5-(3-methylbutyl)-4-oxo-2H-1,5-benzoxazepin-8-yl]-2-methyl-2,3-dihydro-1,4-benzodioxin-3-carboxamide IUPAC Name: N-[3,3-dimethyl-5-(3-methylbutyl)-4-oxo-2H-1,5-benzoxazepin-8-yl]-2-methyl-2,3-dihydro-1,4-benzodioxine-3-carboxamide Traditional Name: N-(5-isoamyl-4-keto-3,3-dimethyl-2H-1,5-benzoxazepin-8-yl)-2-methyl-2,3-dihydro-1,4-benzodioxin-3-carboxamide Formula: C26H32N2O5 MolecularWeight: 452.54268

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(OC2=CC=CC=C2O1)C(=O)NC3=CC4=C(C=C3)N(C(=O)C(CO4)(C)C)CCC(C)C

Isomeric SMILES

CC1C(OC2=CC=CC=C2O1)C(=O)NC3=CC4=C(C=C3)N(C(=O)C(CO4)(C)C)CCC(C)C

InChI

InChI=1S/C26H32N2O5/c1-16(2)12-13-28-19-11-10-18(14-22(19)31-15-26(4,5)25(28)30)27-24(29)23-17(3)32-20-8-6-7-9-21(20)33-23/h6-11,14,16-17,23H,12-13,15H2,1-5H3,(H,27,29)