methyl 2-[methyl-[6-(methylamino)-5-nitro-pyrimidin-4-yl]amino]benzoate

Systemtic Name: methyl 2-[methyl-[6-(methylamino)-5-nitro-pyrimidin-4-yl]amino]benzoate Openeye Name: methyl 2-[methyl-[6-(methylamino)-5-nitro-pyrimidin-4-yl]amino]benzoate CAS Name: 2-[methyl-[6-(methylamino)-5-nitro-4-pyrimidinyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[methyl-[6-(methylamino)-5-nitropyrimidin-4-yl]amino]benzoate Traditional Name: 2-[methyl-[6-(methylamino)-5-nitro-pyrimidin-4-yl]amino]benzoic acid methyl ester Formula: C14H15N5O4 MolecularWeight: 317.3

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C(=NC=N1)N(C)C2=CC=CC=C2C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C(=NC=N1)N(C)C2=CC=CC=C2C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C14H15N5O4/c1-15-12-11(19(21)22)13(17-8-16-12)18(2)10-7-5-4-6-9(10)14(20)23-3/h4-8H,1-3H3,(H,15,16,17)