ethyl 2-[(5-nitro-6-pyridin-3-yloxy-pyrimidin-4-yl)amino]benzoate

Systemtic Name: ethyl 2-[(5-nitro-6-pyridin-3-yloxy-pyrimidin-4-yl)amino]benzoate Openeye Name: ethyl 2-[[5-nitro-6-(3-pyridyloxy)pyrimidin-4-yl]amino]benzoate CAS Name: 2-[[5-nitro-6-(3-pyridinyloxy)-4-pyrimidinyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-[(5-nitro-6-pyridin-3-yloxypyrimidin-4-yl)amino]benzoate Traditional Name: 2-[[5-nitro-6-(3-pyridyloxy)pyrimidin-4-yl]amino]benzoic acid ethyl ester Formula: C18H15N5O5 MolecularWeight: 381.3422

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1NC2=C(C(=NC=N2)OC3=CN=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1NC2=C(C(=NC=N2)OC3=CN=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H15N5O5/c1-2-27-18(24)13-7-3-4-8-14(13)22-16-15(23(25)26)17(21-11-20-16)28-12-6-5-9-19-10-12/h3-11H,2H2,1H3,(H,20,21,22)