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

Systemtic Name: ethyl 3-[[6-(2-chloranylpyridin-3-yl)oxy-5-nitro-pyrimidin-4-yl]-(furan-2-ylmethyl)amino]propanoate Openeye Name: ethyl 3-[[6-[(2-chloro-3-pyridyl)oxy]-5-nitro-pyrimidin-4-yl]-(2-furylmethyl)amino]propanoate CAS Name: 3-[[6-[(2-chloro-3-pyridinyl)oxy]-5-nitro-4-pyrimidinyl]-(2-furanylmethyl)amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[[6-(2-chloropyridin-3-yl)oxy-5-nitropyrimidin-4-yl]-(furan-2-ylmethyl)amino]propanoate Traditional Name: 3-[[6-[(2-chloro-3-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=C(N=CC=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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