4-azanyl-4-[7-(diethylamino)-2-oxidanylidene-chromen-4-yl]-2-methyl-butanoic acid; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: 4-azanyl-4-[7-(diethylamino)-2-oxidanylidene-chromen-4-yl]-2-methyl-butanoic acid; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: 4-amino-4-[7-(diethylamino)-2-oxo-chromen-4-yl]-2-methyl-butanoic acid; 2,2,2-trifluoroacetic acid CAS Name: 4-amino-4-[7-(diethylamino)-2-oxo-1-benzopyran-4-yl]-2-methylbutanoic acid; 2,2,2-trifluoroacetic acid IUPAC Name: 4-amino-4-[7-(diethylamino)-2-oxochromen-4-yl]-2-methylbutanoic acid; 2,2,2-trifluoroacetic acid Traditional Name: 4-amino-4-[7-(diethylamino)-2-keto-chromen-4-yl]-2-methyl-butyric acid; 2,2,2-trifluoroacetic acid Formula: C20H25F3N2O6 MolecularWeight: 446.41751

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC2=C(C=C1)C(=CC(=O)O2)C(CC(C)C(=O)O)N.C(=O)(C(F)(F)F)O

Isomeric SMILES

CCN(CC)C1=CC2=C(C=C1)C(=CC(=O)O2)C(CC(C)C(=O)O)N.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C18H24N2O4.C2HF3O2/c1-4-20(5-2)12-6-7-13-14(10-17(21)24-16(13)9-12)15(19)8-11(3)18(22)23;3-2(4,5)1(6)7/h6-7,9-11,15H,4-5,8,19H2,1-3H3,(H,22,23);(H,6,7)