2-azanyl-4-[4-methoxy-3-[2,2,2-tris(fluoranyl)ethoxymethyl]phenyl]-5-oxidanylidene-4,6,7,8-tetrahydrochromene-3-carbonitrile

Systemtic Name: 2-azanyl-4-[4-methoxy-3-[2,2,2-tris(fluoranyl)ethoxymethyl]phenyl]-5-oxidanylidene-4,6,7,8-tetrahydrochromene-3-carbonitrile Openeye Name: 2-amino-4-[4-methoxy-3-(2,2,2-trifluoroethoxymethyl)phenyl]-5-oxo-4,6,7,8-tetrahydrochromene-3-carbonitrile CAS Name: 2-amino-4-[4-methoxy-3-(2,2,2-trifluoroethoxymethyl)phenyl]-5-oxo-4,6,7,8-tetrahydro-1-benzopyran-3-carbonitrile IUPAC Name: 2-amino-4-[4-methoxy-3-(2,2,2-trifluoroethoxymethyl)phenyl]-5-oxo-4,6,7,8-tetrahydrochromene-3-carbonitrile Traditional Name: 2-amino-5-keto-4-[4-methoxy-3-(2,2,2-trifluoroethoxymethyl)phenyl]-4,6,7,8-tetrahydrochromene-3-carbonitrile Formula: C20H19F3N2O4 MolecularWeight: 408.37107

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2C(=C(OC3=C2C(=O)CCC3)N)C#N)COCC(F)(F)F

Isomeric SMILES

COC1=C(C=C(C=C1)C2C(=C(OC3=C2C(=O)CCC3)N)C#N)COCC(F)(F)F

InChI

InChI=1S/C20H19F3N2O4/c1-27-15-6-5-11(7-12(15)9-28-10-20(21,22)23)17-13(8-24)19(25)29-16-4-2-3-14(26)18(16)17/h5-7,17H,2-4,9-10,25H2,1H3