2-[2,3-bis(chloranyl)-1-cyano-4H-azirino[2,3-h]quinazolin-5-yl]ethanoate

Systemtic Name: 2-[2,3-bis(chloranyl)-1-cyano-4H-azirino[2,3-h]quinazolin-5-yl]ethanoate Openeye Name: 2-(2,3-dichloro-1-cyano-4H-azirino[2,3-h]quinazolin-5-yl)acetate CAS Name: 2-(2,3-dichloro-1-cyano-4H-azirino[2,3-h]quinazolin-5-yl)acetate IUPAC Name: 2-(2,3-dichloro-1-cyano-4H-azirino[2,3-h]quinazolin-5-yl)acetate Traditional Name: 2-(2,3-dichloro-1-cyano-4H-azirino[2,3-h]quinazolin-5-yl)acetate Formula: C11H5Cl2N4O2- MolecularWeight: 296.089

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C3=C(N3C#N)C(=C2Cl)Cl)N=CN1CC(=O)[O-]

Isomeric SMILES

C1C2=C(C3=C(N3C#N)C(=C2Cl)Cl)N=CN1CC(=O)[O-]

InChI

InChI=1S/C11H6Cl2N4O2/c12-7-5-1-16(2-6(18)19)4-15-9(5)11-10(8(7)13)17(11)3-14/h4H,1-2H2,(H,18,19)/p-1