(3S,4R)-4-(1-ethyl-6-oxidanylidene-pyridazin-3-yl)oxy-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromene-6-carbonitrile

Systemtic Name: (3S,4R)-4-(1-ethyl-6-oxidanylidene-pyridazin-3-yl)oxy-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromene-6-carbonitrile Openeye Name: (3S,4R)-4-(1-ethyl-6-oxo-pyridazin-3-yl)oxy-3-hydroxy-2,2-dimethyl-chromane-6-carbonitrile CAS Name: (3S,4R)-4-[(1-ethyl-6-oxo-3-pyridazinyl)oxy]-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-6-carbonitrile IUPAC Name: (3S,4R)-4-(1-ethyl-6-oxopyridazin-3-yl)oxy-3-hydroxy-2,2-dimethyl-3,4-dihydrochromene-6-carbonitrile Traditional Name: (3S,4R)-4-(1-ethyl-6-keto-pyridazin-3-yl)oxy-3-hydroxy-2,2-dimethyl-chroman-6-carbonitrile Formula: C18H19N3O4 MolecularWeight: 341.36116

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C=CC(=N1)OC2C(C(OC3=C2C=C(C=C3)C#N)(C)C)O

Isomeric SMILES

CCN1C(=O)C=CC(=N1)O[C@H]2[C@@H](C(OC3=C2C=C(C=C3)C#N)(C)C)O

InChI

InChI=1S/C18H19N3O4/c1-4-21-15(22)8-7-14(20-21)24-16-12-9-11(10-19)5-6-13(12)25-18(2,3)17(16)23/h5-9,16-17,23H,4H2,1-3H3/t16-,17+/m1/s1