ethyl 1-(6-cyano-2,2-dimethyl-chromen-4-yl)-6-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: ethyl 1-(6-cyano-2,2-dimethyl-chromen-4-yl)-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: ethyl 1-(6-cyano-2,2-dimethyl-chromen-4-yl)-6-oxo-pyridazine-3-carboxylate CAS Name: 1-(6-cyano-2,2-dimethyl-1-benzopyran-4-yl)-6-oxo-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(6-cyano-2,2-dimethylchromen-4-yl)-6-oxopyridazine-3-carboxylate Traditional Name: 1-(6-cyano-2,2-dimethyl-chromen-4-yl)-6-keto-pyridazine-3-carboxylic acid ethyl ester Formula: C19H17N3O4 MolecularWeight: 351.35598

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C=C1)C2=CC(OC3=C2C=C(C=C3)C#N)(C)C

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C=C1)C2=CC(OC3=C2C=C(C=C3)C#N)(C)C

InChI

InChI=1S/C19H17N3O4/c1-4-25-18(24)14-6-8-17(23)22(21-14)15-10-19(2,3)26-16-7-5-12(11-20)9-13(15)16/h5-10H,4H2,1-3H3