2-(4-tert-butylphenoxy)-N-[3,3-dimethyl-5-(2-methylpropyl)-4-oxidanylidene-2H-1,5-benzoxazepin-7-yl]ethanamide

Systemtic Name: 2-(4-tert-butylphenoxy)-N-[3,3-dimethyl-5-(2-methylpropyl)-4-oxidanylidene-2H-1,5-benzoxazepin-7-yl]ethanamide Openeye Name: 2-(4-tert-butylphenoxy)-N-(5-isobutyl-3,3-dimethyl-4-oxo-2H-1,5-benzoxazepin-7-yl)acetamide CAS Name: 2-(4-tert-butylphenoxy)-N-[3,3-dimethyl-5-(2-methylpropyl)-4-oxo-2H-1,5-benzoxazepin-7-yl]acetamide IUPAC Name: 2-(4-tert-butylphenoxy)-N-[3,3-dimethyl-5-(2-methylpropyl)-4-oxo-2H-1,5-benzoxazepin-7-yl]acetamide Traditional Name: 2-(4-tert-butylphenoxy)-N-(5-isobutyl-4-keto-3,3-dimethyl-2H-1,5-benzoxazepin-7-yl)acetamide Formula: C27H36N2O4 MolecularWeight: 452.58574

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=C(C=CC(=C2)NC(=O)COC3=CC=C(C=C3)C(C)(C)C)OCC(C1=O)(C)C

Isomeric SMILES

CC(C)CN1C2=C(C=CC(=C2)NC(=O)COC3=CC=C(C=C3)C(C)(C)C)OCC(C1=O)(C)C

InChI

InChI=1S/C27H36N2O4/c1-18(2)15-29-22-14-20(10-13-23(22)33-17-27(6,7)25(29)31)28-24(30)16-32-21-11-8-19(9-12-21)26(3,4)5/h8-14,18H,15-17H2,1-7H3,(H,28,30)