methyl 2-(9-chloranyl-5-oxidanylidene-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)ethanoate

Systemtic Name: methyl 2-(9-chloranyl-5-oxidanylidene-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)ethanoate Openeye Name: methyl 2-(9-chloro-5-oxo-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)acetate CAS Name: 2-(9-chloro-5-oxo-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)acetic acid methyl ester IUPAC Name: methyl 2-(9-chloro-5-oxo-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)acetate Traditional Name: 2-(9-chloro-5-keto-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)acetic acid methyl ester Formula: C12H12ClNO4 MolecularWeight: 269.68098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC(=C2C(=C1)C(=O)NCCO2)Cl

Isomeric SMILES

COC(=O)CC1=CC(=C2C(=C1)C(=O)NCCO2)Cl

InChI

InChI=1S/C12H12ClNO4/c1-17-10(15)6-7-4-8-11(9(13)5-7)18-3-2-14-12(8)16/h4-5H,2-3,6H2,1H3,(H,14,16)