ethyl 3-[furan-2-ylmethyl-[5-nitro-6-(2-oxidanylidenechromen-7-yl)oxy-pyrimidin-4-yl]amino]propanoate

Systemtic Name: ethyl 3-[furan-2-ylmethyl-[5-nitro-6-(2-oxidanylidenechromen-7-yl)oxy-pyrimidin-4-yl]amino]propanoate Openeye Name: ethyl 3-[2-furylmethyl-[5-nitro-6-(2-oxochromen-7-yl)oxy-pyrimidin-4-yl]amino]propanoate CAS Name: 3-[2-furanylmethyl-[5-nitro-6-[(2-oxo-1-benzopyran-7-yl)oxy]-4-pyrimidinyl]amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[furan-2-ylmethyl-[5-nitro-6-(2-oxochromen-7-yl)oxypyrimidin-4-yl]amino]propanoate Traditional Name: 3-[2-furfuryl-[6-(2-ketochromen-7-yl)oxy-5-nitro-pyrimidin-4-yl]amino]propionic acid ethyl ester Formula: C23H20N4O8 MolecularWeight: 480.4269

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN(CC1=CC=CO1)C2=C(C(=NC=N2)OC3=CC4=C(C=C3)C=CC(=O)O4)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CCN(CC1=CC=CO1)C2=C(C(=NC=N2)OC3=CC4=C(C=C3)C=CC(=O)O4)[N+](=O)[O-]

InChI

InChI=1S/C23H20N4O8/c1-2-32-19(28)9-10-26(13-17-4-3-11-33-17)22-21(27(30)31)23(25-14-24-22)34-16-7-5-15-6-8-20(29)35-18(15)12-16/h3-8,11-12,14H,2,9-10,13H2,1H3