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

Systemtic Name: 4-chloranyl-N-(3,3-dimethyl-4-oxidanylidene-5-prop-2-enyl-2H-1,5-benzoxazepin-8-yl)butanamide Openeye Name: N-(5-allyl-3,3-dimethyl-4-oxo-2H-1,5-benzoxazepin-8-yl)-4-chloro-butanamide CAS Name: 4-chloro-N-(3,3-dimethyl-4-oxo-5-prop-2-enyl-2H-1,5-benzoxazepin-8-yl)butanamide IUPAC Name: 4-chloro-N-(3,3-dimethyl-4-oxo-5-prop-2-enyl-2H-1,5-benzoxazepin-8-yl)butanamide Traditional Name: N-(5-allyl-4-keto-3,3-dimethyl-2H-1,5-benzoxazepin-8-yl)-4-chloro-butyramide Formula: C18H23ClN2O3 MolecularWeight: 350.83982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(COC2=C(C=CC(=C2)NC(=O)CCCCl)N(C1=O)CC=C)C

Isomeric SMILES

CC1(COC2=C(C=CC(=C2)NC(=O)CCCCl)N(C1=O)CC=C)C

InChI

InChI=1S/C18H23ClN2O3/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/h4,7-8,11H,1,5-6,9-10,12H2,2-3H3,(H,20,22)