ethyl 3-[[6-(6-chloranylpyridin-2-yl)oxy-5-nitro-pyrimidin-4-yl]-(furan-2-ylmethyl)amino]propanoate

Systemtic Name: ethyl 3-[[6-(6-chloranylpyridin-2-yl)oxy-5-nitro-pyrimidin-4-yl]-(furan-2-ylmethyl)amino]propanoate Openeye Name: ethyl 3-[[6-[(6-chloro-2-pyridyl)oxy]-5-nitro-pyrimidin-4-yl]-(2-furylmethyl)amino]propanoate CAS Name: 3-[[6-[(6-chloro-2-pyridinyl)oxy]-5-nitro-4-pyrimidinyl]-(2-furanylmethyl)amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[[6-(6-chloropyridin-2-yl)oxy-5-nitropyrimidin-4-yl]-(furan-2-ylmethyl)amino]propanoate Traditional Name: 3-[[6-[(6-chloro-2-pyridyl)oxy]-5-nitro-pyrimidin-4-yl]-(2-furfuryl)amino]propionic acid ethyl ester Formula: C19H18ClN5O6 MolecularWeight: 447.82912

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN(CC1=CC=CO1)C2=C(C(=NC=N2)OC3=NC(=CC=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CCN(CC1=CC=CO1)C2=C(C(=NC=N2)OC3=NC(=CC=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H18ClN5O6/c1-2-29-16(26)8-9-24(11-13-5-4-10-30-13)18-17(25(27)28)19(22-12-21-18)31-15-7-3-6-14(20)23-15/h3-7,10,12H,2,8-9,11H2,1H3