8-[[2,6-bis(fluoranyl)phenyl]methyl]-3-methyl-2-(4-nitrophenyl)-5-oxidanylidene-imidazo[1,2-a]pyrimidine-6-carboxylic acid

Systemtic Name: 8-[[2,6-bis(fluoranyl)phenyl]methyl]-3-methyl-2-(4-nitrophenyl)-5-oxidanylidene-imidazo[1,2-a]pyrimidine-6-carboxylic acid Openeye Name: 8-[(2,6-difluorophenyl)methyl]-3-methyl-2-(4-nitrophenyl)-5-oxo-imidazo[1,2-a]pyrimidine-6-carboxylic acid CAS Name: 8-[(2,6-difluorophenyl)methyl]-3-methyl-2-(4-nitrophenyl)-5-oxo-6-imidazo[1,2-a]pyrimidinecarboxylic acid IUPAC Name: 8-[(2,6-difluorophenyl)methyl]-3-methyl-2-(4-nitrophenyl)-5-oxoimidazo[1,2-a]pyrimidine-6-carboxylic acid Traditional Name: 8-(2,6-difluorobenzyl)-5-keto-3-methyl-2-(4-nitrophenyl)imidazo[1,2-a]pyrimidine-6-carboxylic acid Formula: C21H14F2N4O5 MolecularWeight: 440.356466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C2N1C(=O)C(=CN2CC3=C(C=CC=C3F)F)C(=O)O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(N=C2N1C(=O)C(=CN2CC3=C(C=CC=C3F)F)C(=O)O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H14F2N4O5/c1-11-18(12-5-7-13(8-6-12)27(31)32)24-21-25(9-14-16(22)3-2-4-17(14)23)10-15(20(29)30)19(28)26(11)21/h2-8,10H,9H2,1H3,(H,29,30)