4-chloranyl-N-[3,3-dimethyl-5-(2-methylpropyl)-4-oxidanylidene-2H-1,5-benzoxazepin-7-yl]butanamide

Systemtic Name: 4-chloranyl-N-[3,3-dimethyl-5-(2-methylpropyl)-4-oxidanylidene-2H-1,5-benzoxazepin-7-yl]butanamide Openeye Name: 4-chloro-N-(5-isobutyl-3,3-dimethyl-4-oxo-2H-1,5-benzoxazepin-7-yl)butanamide CAS Name: 4-chloro-N-[3,3-dimethyl-5-(2-methylpropyl)-4-oxo-2H-1,5-benzoxazepin-7-yl]butanamide IUPAC Name: 4-chloro-N-[3,3-dimethyl-5-(2-methylpropyl)-4-oxo-2H-1,5-benzoxazepin-7-yl]butanamide Traditional Name: 4-chloro-N-(5-isobutyl-4-keto-3,3-dimethyl-2H-1,5-benzoxazepin-7-yl)butyramide Formula: C19H27ClN2O3 MolecularWeight: 366.88228

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=C(C=CC(=C2)NC(=O)CCCCl)OCC(C1=O)(C)C

Isomeric SMILES

CC(C)CN1C2=C(C=CC(=C2)NC(=O)CCCCl)OCC(C1=O)(C)C

InChI

InChI=1S/C19H27ClN2O3/c1-13(2)11-22-15-10-14(21-17(23)6-5-9-20)7-8-16(15)25-12-19(3,4)18(22)24/h7-8,10,13H,5-6,9,11-12H2,1-4H3,(H,21,23)