[3-cyano-2-methyl-4-(2-methyl-4-oxidanylidene-chromen-8-yl)-1,4-dihydro-1,6-naphthyridin-5-yl] tris(fluoranyl)methanesulfonate

Systemtic Name: [3-cyano-2-methyl-4-(2-methyl-4-oxidanylidene-chromen-8-yl)-1,4-dihydro-1,6-naphthyridin-5-yl] tris(fluoranyl)methanesulfonate Openeye Name: [3-cyano-2-methyl-4-(2-methyl-4-oxo-chromen-8-yl)-1,4-dihydro-1,6-naphthyridin-5-yl] trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid [3-cyano-2-methyl-4-(2-methyl-4-oxo-1-benzopyran-8-yl)-1,4-dihydro-1,6-naphthyridin-5-yl] ester IUPAC Name: [3-cyano-2-methyl-4-(2-methyl-4-oxochromen-8-yl)-1,4-dihydro-1,6-naphthyridin-5-yl] trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid [3-cyano-4-(4-keto-2-methyl-chromen-8-yl)-2-methyl-1,4-dihydro-1,6-naphthyridin-5-yl] ester Formula: C21H14F3N3O5S MolecularWeight: 477.41317

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C2=C(O1)C(=CC=C2)C3C(=C(NC4=C3C(=NC=C4)OS(=O)(=O)C(F)(F)F)C)C#N

Isomeric SMILES

CC1=CC(=O)C2=C(O1)C(=CC=C2)C3C(=C(NC4=C3C(=NC=C4)OS(=O)(=O)C(F)(F)F)C)C#N

InChI

InChI=1S/C21H14F3N3O5S/c1-10-8-16(28)12-4-3-5-13(19(12)31-10)17-14(9-25)11(2)27-15-6-7-26-20(18(15)17)32-33(29,30)21(22,23)24/h3-8,17,27H,1-2H3