ethyl 3-[[6-[(2-ethanoyl-1-benzofuran-7-yl)oxy]-5-nitro-pyrimidin-4-yl]-(furan-2-ylmethyl)amino]propanoate

Systemtic Name: ethyl 3-[[6-[(2-ethanoyl-1-benzofuran-7-yl)oxy]-5-nitro-pyrimidin-4-yl]-(furan-2-ylmethyl)amino]propanoate Openeye Name: ethyl 3-[[6-(2-acetylbenzofuran-7-yl)oxy-5-nitro-pyrimidin-4-yl]-(2-furylmethyl)amino]propanoate CAS Name: 3-[[6-[(2-acetyl-7-benzofuranyl)oxy]-5-nitro-4-pyrimidinyl]-(2-furanylmethyl)amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[[6-[(2-acetyl-1-benzofuran-7-yl)oxy]-5-nitropyrimidin-4-yl]-(furan-2-ylmethyl)amino]propanoate Traditional Name: 3-[[6-(2-acetylbenzofuran-7-yl)oxy-5-nitro-pyrimidin-4-yl]-(2-furfuryl)amino]propionic acid ethyl ester Formula: C24H22N4O8 MolecularWeight: 494.45348

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN(CC1=CC=CO1)C2=C(C(=NC=N2)OC3=CC=CC4=C3OC(=C4)C(=O)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CCN(CC1=CC=CO1)C2=C(C(=NC=N2)OC3=CC=CC4=C3OC(=C4)C(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C24H22N4O8/c1-3-33-20(30)9-10-27(13-17-7-5-11-34-17)23-21(28(31)32)24(26-14-25-23)36-18-8-4-6-16-12-19(15(2)29)35-22(16)18/h4-8,11-12,14H,3,9-10,13H2,1-2H3