ethyl 2-(3-chloranyl-9-methyl-5-oxidanylidene-pyridazino[3,4-b][1,5]benzoxazepin-6-yl)ethanoate

Systemtic Name: ethyl 2-(3-chloranyl-9-methyl-5-oxidanylidene-pyridazino[3,4-b][1,5]benzoxazepin-6-yl)ethanoate Openeye Name: ethyl 2-(3-chloro-9-methyl-5-oxo-pyridazino[3,4-b][1,5]benzoxazepin-6-yl)acetate CAS Name: 2-(3-chloro-9-methyl-5-oxo-6-pyridazino[3,4-b][1,5]benzoxazepinyl)acetic acid ethyl ester IUPAC Name: ethyl 2-(3-chloro-9-methyl-5-oxopyridazino[3,4-b][1,5]benzoxazepin-6-yl)acetate Traditional Name: 2-(3-chloro-5-keto-9-methyl-pyridazino[3,4-b][1,5]benzoxazepin-6-yl)acetic acid ethyl ester Formula: C16H14ClN3O4 MolecularWeight: 347.75306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=C(C=C2)C)OC3=NN=C(C=C3C1=O)Cl

Isomeric SMILES

CCOC(=O)CN1C2=C(C=C(C=C2)C)OC3=NN=C(C=C3C1=O)Cl

InChI

InChI=1S/C16H14ClN3O4/c1-3-23-14(21)8-20-11-5-4-9(2)6-12(11)24-15-10(16(20)22)7-13(17)18-19-15/h4-7H,3,8H2,1-2H3