methyl 4-[6-[ethyl-(3-methylphenyl)amino]-5-nitro-pyrimidin-4-yl]oxybenzoate

Systemtic Name: methyl 4-[6-[ethyl-(3-methylphenyl)amino]-5-nitro-pyrimidin-4-yl]oxybenzoate Openeye Name: methyl 4-[6-(N-ethyl-3-methyl-anilino)-5-nitro-pyrimidin-4-yl]oxybenzoate CAS Name: 4-[[6-(N-ethyl-3-methylanilino)-5-nitro-4-pyrimidinyl]oxy]benzoic acid methyl ester IUPAC Name: methyl 4-[6-(N-ethyl-3-methylanilino)-5-nitropyrimidin-4-yl]oxybenzoate Traditional Name: 4-[6-(N-ethyl-3-methyl-anilino)-5-nitro-pyrimidin-4-yl]oxybenzoic acid methyl ester Formula: C21H20N4O5 MolecularWeight: 408.4073

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC(=C1)C)C2=C(C(=NC=N2)OC3=CC=C(C=C3)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CCN(C1=CC=CC(=C1)C)C2=C(C(=NC=N2)OC3=CC=C(C=C3)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C21H20N4O5/c1-4-24(16-7-5-6-14(2)12-16)19-18(25(27)28)20(23-13-22-19)30-17-10-8-15(9-11-17)21(26)29-3/h5-13H,4H2,1-3H3