[3-acetyloxy-5-[5-bromanyl-4-[(2-nitro-6-oxidanyl-phenyl)amino]-2-oxidanylidene-pyrimidin-1-yl]oxolan-2-yl]methyl ethanoate

Systemtic Name: [3-acetyloxy-5-[5-bromanyl-4-[(2-nitro-6-oxidanyl-phenyl)amino]-2-oxidanylidene-pyrimidin-1-yl]oxolan-2-yl]methyl ethanoate Openeye Name: [3-acetoxy-5-[5-bromo-4-(2-hydroxy-6-nitro-anilino)-2-oxo-pyrimidin-1-yl]tetrahydrofuran-2-yl]methyl acetate CAS Name: acetic acid [3-acetyloxy-5-[5-bromo-4-(2-hydroxy-6-nitroanilino)-2-oxo-1-pyrimidinyl]-2-oxolanyl]methyl ester IUPAC Name: [3-acetyloxy-5-[5-bromo-4-(2-hydroxy-6-nitroanilino)-2-oxopyrimidin-1-yl]oxolan-2-yl]methyl acetate Traditional Name: acetic acid [3-acetoxy-5-[5-bromo-4-(2-hydroxy-6-nitro-anilino)-2-keto-pyrimidin-1-yl]tetrahydrofuran-2-yl]methyl ester Formula: C19H19BrN4O9 MolecularWeight: 527.27956

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(CC(O1)N2C=C(C(=NC2=O)NC3=C(C=CC=C3O)[N+](=O)[O-])Br)OC(=O)C

Isomeric SMILES

CC(=O)OCC1C(CC(O1)N2C=C(C(=NC2=O)NC3=C(C=CC=C3O)[N+](=O)[O-])Br)OC(=O)C

InChI

InChI=1S/C19H19BrN4O9/c1-9(25)31-8-15-14(32-10(2)26)6-16(33-15)23-7-11(20)18(22-19(23)28)21-17-12(24(29)30)4-3-5-13(17)27/h3-5,7,14-16,27H,6,8H2,1-2H3,(H,21,22,28)