methyl 4-[6-[(6-methylpyridin-2-yl)amino]-5-nitro-pyrimidin-4-yl]oxybenzoate

Systemtic Name: methyl 4-[6-[(6-methylpyridin-2-yl)amino]-5-nitro-pyrimidin-4-yl]oxybenzoate Openeye Name: methyl 4-[6-[(6-methyl-2-pyridyl)amino]-5-nitro-pyrimidin-4-yl]oxybenzoate CAS Name: 4-[[6-[(6-methyl-2-pyridinyl)amino]-5-nitro-4-pyrimidinyl]oxy]benzoic acid methyl ester IUPAC Name: methyl 4-[6-[(6-methylpyridin-2-yl)amino]-5-nitropyrimidin-4-yl]oxybenzoate Traditional Name: 4-[6-[(6-methyl-2-pyridyl)amino]-5-nitro-pyrimidin-4-yl]oxybenzoic acid methyl ester Formula: C18H15N5O5 MolecularWeight: 381.3422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)NC2=C(C(=NC=N2)OC3=CC=C(C=C3)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=CC=C1)NC2=C(C(=NC=N2)OC3=CC=C(C=C3)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C18H15N5O5/c1-11-4-3-5-14(21-11)22-16-15(23(25)26)17(20-10-19-16)28-13-8-6-12(7-9-13)18(24)27-2/h3-10H,1-2H3,(H,19,20,21,22)