2-(methoxymethyl)-2-methyl-4-(1-methyl-6-oxidanylidene-pyridazin-3-yl)oxy-3-oxidanyl-3,4-dihydrochromene-6-carbonitrile

Systemtic Name: 2-(methoxymethyl)-2-methyl-4-(1-methyl-6-oxidanylidene-pyridazin-3-yl)oxy-3-oxidanyl-3,4-dihydrochromene-6-carbonitrile Openeye Name: 3-hydroxy-2-(methoxymethyl)-2-methyl-4-(1-methyl-6-oxo-pyridazin-3-yl)oxy-chromane-6-carbonitrile CAS Name: 3-hydroxy-2-(methoxymethyl)-2-methyl-4-[(1-methyl-6-oxo-3-pyridazinyl)oxy]-3,4-dihydro-2H-1-benzopyran-6-carbonitrile IUPAC Name: 3-hydroxy-2-(methoxymethyl)-2-methyl-4-(1-methyl-6-oxopyridazin-3-yl)oxy-3,4-dihydrochromene-6-carbonitrile Traditional Name: 3-hydroxy-4-(6-keto-1-methyl-pyridazin-3-yl)oxy-2-(methoxymethyl)-2-methyl-chroman-6-carbonitrile Formula: C18H19N3O5 MolecularWeight: 357.36056

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)OC3=NN(C(=O)C=C3)C)O)COC

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)OC3=NN(C(=O)C=C3)C)O)COC

InChI

InChI=1S/C18H19N3O5/c1-18(10-24-3)17(23)16(25-14-6-7-15(22)21(2)20-14)12-8-11(9-19)4-5-13(12)26-18/h4-8,16-17,23H,10H2,1-3H3