[1-oxidanylidene-1-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)propan-2-yl] 6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxylate

Systemtic Name: [1-oxidanylidene-1-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)propan-2-yl] 6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxylate Openeye Name: [1-methyl-2-oxo-2-(3-oxo-4H-1,4-benzoxazin-6-yl)ethyl] 6-chloro-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxylate CAS Name: 6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxylic acid [1-oxo-1-(3-oxo-4H-1,4-benzoxazin-6-yl)propan-2-yl] ester IUPAC Name: [1-oxo-1-(3-oxo-4H-1,4-benzoxazin-6-yl)propan-2-yl] 6-chloro-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxylate Traditional Name: 6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxylic acid [2-keto-2-(3-keto-4H-1,4-benzoxazin-6-yl)-1-methyl-ethyl] ester Formula: C21H18ClNO7 MolecularWeight: 431.82312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC2=C(C=C1)OCC(=O)N2)OC(=O)C3=CC4=C(C(=C3)Cl)OCCCO4

Isomeric SMILES

CC(C(=O)C1=CC2=C(C=C1)OCC(=O)N2)OC(=O)C3=CC4=C(C(=C3)Cl)OCCCO4

InChI

InChI=1S/C21H18ClNO7/c1-11(19(25)12-3-4-16-15(8-12)23-18(24)10-29-16)30-21(26)13-7-14(22)20-17(9-13)27-5-2-6-28-20/h3-4,7-9,11H,2,5-6,10H2,1H3,(H,23,24)