4-chloranyl-N-(3,3-dimethyl-4-oxidanylidene-5-propyl-2H-1,5-benzoxazepin-8-yl)butanamide

Systemtic Name: 4-chloranyl-N-(3,3-dimethyl-4-oxidanylidene-5-propyl-2H-1,5-benzoxazepin-8-yl)butanamide Openeye Name: 4-chloro-N-(3,3-dimethyl-4-oxo-5-propyl-2H-1,5-benzoxazepin-8-yl)butanamide CAS Name: 4-chloro-N-(3,3-dimethyl-4-oxo-5-propyl-2H-1,5-benzoxazepin-8-yl)butanamide IUPAC Name: 4-chloro-N-(3,3-dimethyl-4-oxo-5-propyl-2H-1,5-benzoxazepin-8-yl)butanamide Traditional Name: 4-chloro-N-(4-keto-3,3-dimethyl-5-propyl-2H-1,5-benzoxazepin-8-yl)butyramide Formula: C18H25ClN2O3 MolecularWeight: 352.8557

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)NC(=O)CCCCl)OCC(C1=O)(C)C

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)NC(=O)CCCCl)OCC(C1=O)(C)C

InChI

InChI=1S/C18H25ClN2O3/c1-4-10-21-14-8-7-13(20-16(22)6-5-9-19)11-15(14)24-12-18(2,3)17(21)23/h7-8,11H,4-6,9-10,12H2,1-3H3,(H,20,22)