ethyl 3-[[1-(2-fluorophenyl)-2,4,6-tris(oxidanylidene)-1,3-diazinan-5-ylidene]methyl]-1H-indole-2-carboxylate

Systemtic Name: ethyl 3-[[1-(2-fluorophenyl)-2,4,6-tris(oxidanylidene)-1,3-diazinan-5-ylidene]methyl]-1H-indole-2-carboxylate Openeye Name: ethyl 3-[[1-(2-fluorophenyl)-2,4,6-trioxo-hexahydropyrimidin-5-ylidene]methyl]-1H-indole-2-carboxylate CAS Name: 3-[[1-(2-fluorophenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[[1-(2-fluorophenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]-1H-indole-2-carboxylate Traditional Name: 3-[[1-(2-fluorophenyl)-2,4,6-triketo-hexahydropyrimidin-5-ylidene]methyl]-1H-indole-2-carboxylic acid ethyl ester Formula: C22H16FN3O5 MolecularWeight: 421.377943

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2N1)C=C3C(=O)NC(=O)N(C3=O)C4=CC=CC=C4F

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2N1)C=C3C(=O)NC(=O)N(C3=O)C4=CC=CC=C4F

InChI

InChI=1S/C22H16FN3O5/c1-2-31-21(29)18-13(12-7-3-5-9-16(12)24-18)11-14-19(27)25-22(30)26(20(14)28)17-10-6-4-8-15(17)23/h3-11,24H,2H2,1H3,(H,25,27,30)