methyl (1E)-N-[[4-(5-bromanylpyrimidin-2-yl)oxy-3-methyl-phenyl]carbamoyl]-2-nitro-benzenecarboximidate

Systemtic Name: methyl (1E)-N-[[4-(5-bromanylpyrimidin-2-yl)oxy-3-methyl-phenyl]carbamoyl]-2-nitro-benzenecarboximidate Openeye Name: methyl (1E)-N-[[4-(5-bromopyrimidin-2-yl)oxy-3-methyl-phenyl]carbamoyl]-2-nitro-benzenecarboximidate CAS Name: (1E)-N-[[4-[(5-bromo-2-pyrimidinyl)oxy]-3-methylanilino]-oxomethyl]-2-nitrobenzenecarboximidic acid methyl ester IUPAC Name: methyl (1E)-N-[[4-(5-bromopyrimidin-2-yl)oxy-3-methylphenyl]carbamoyl]-2-nitrobenzenecarboximidate Traditional Name: (1E)-N-[[4-(5-bromopyrimidin-2-yl)oxy-3-methyl-phenyl]carbamoyl]-2-nitro-benzenecarboximidic acid methyl ester Formula: C20H16BrN5O5 MolecularWeight: 486.27554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)N=C(C2=CC=CC=C2[N+](=O)[O-])OC)OC3=NC=C(C=N3)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)/N=C(\C2=CC=CC=C2[N+](=O)[O-])/OC)OC3=NC=C(C=N3)Br

InChI

InChI=1S/C20H16BrN5O5/c1-12-9-14(7-8-17(12)31-20-22-10-13(21)11-23-20)24-19(27)25-18(30-2)15-5-3-4-6-16(15)26(28)29/h3-11H,1-2H3,(H,24,27)/b25-18+