(3S,4R)-4-(1-ethyl-6-oxidanylidene-pyridazin-3-yl)oxy-2,2,3-trimethyl-3-oxidanyl-4H-chromene-6-carbonitrile

Systemtic Name: (3S,4R)-4-(1-ethyl-6-oxidanylidene-pyridazin-3-yl)oxy-2,2,3-trimethyl-3-oxidanyl-4H-chromene-6-carbonitrile Openeye Name: (3S,4R)-4-(1-ethyl-6-oxo-pyridazin-3-yl)oxy-3-hydroxy-2,2,3-trimethyl-chromane-6-carbonitrile CAS Name: (3S,4R)-4-[(1-ethyl-6-oxo-3-pyridazinyl)oxy]-3-hydroxy-2,2,3-trimethyl-3,4-dihydro-2H-1-benzopyran-6-carbonitrile IUPAC Name: (3S,4R)-4-(1-ethyl-6-oxopyridazin-3-yl)oxy-3-hydroxy-2,2,3-trimethyl-4H-chromene-6-carbonitrile Traditional Name: (3S,4R)-4-(1-ethyl-6-keto-pyridazin-3-yl)oxy-3-hydroxy-2,2,3-trimethyl-chroman-6-carbonitrile Formula: C19H21N3O4 MolecularWeight: 355.38774

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C=CC(=N1)OC2C3=C(C=CC(=C3)C#N)OC(C2(C)O)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C19H21N3O4/c1-5-22-16(23)9-8-15(21-22)25-17-13-10-12(11-20)6-7-14(13)26-18(2,3)19(17,4)24/h6-10,17,24H,5H2,1-4H3/t17-,19+/m1/s1