methyl 4-(6-azanyl-5-nitro-pyrimidin-4-yl)oxybenzoate

Systemtic Name: methyl 4-(6-azanyl-5-nitro-pyrimidin-4-yl)oxybenzoate Openeye Name: methyl 4-(6-amino-5-nitro-pyrimidin-4-yl)oxybenzoate CAS Name: 4-[(6-amino-5-nitro-4-pyrimidinyl)oxy]benzoic acid methyl ester IUPAC Name: methyl 4-(6-amino-5-nitropyrimidin-4-yl)oxybenzoate Traditional Name: 4-(6-amino-5-nitro-pyrimidin-4-yl)oxybenzoic acid methyl ester Formula: C12H10N4O5 MolecularWeight: 290.2316

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])N

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])N

InChI

InChI=1S/C12H10N4O5/c1-20-12(17)7-2-4-8(5-3-7)21-11-9(16(18)19)10(13)14-6-15-11/h2-6H,1H3,(H2,13,14,15)