methyl 2-[6-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-5-nitro-pyrimidin-4-yl]oxy-4-methoxy-benzoate

Systemtic Name: methyl 2-[6-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-5-nitro-pyrimidin-4-yl]oxy-4-methoxy-benzoate Openeye Name: methyl 2-[6-[4-(furan-2-carbonyl)piperazin-1-yl]-5-nitro-pyrimidin-4-yl]oxy-4-methoxy-benzoate CAS Name: 2-[[6-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-5-nitro-4-pyrimidinyl]oxy]-4-methoxybenzoic acid methyl ester IUPAC Name: methyl 2-[6-[4-(furan-2-carbonyl)piperazin-1-yl]-5-nitropyrimidin-4-yl]oxy-4-methoxybenzoate Traditional Name: 2-[6-[4-(2-furoyl)piperazino]-5-nitro-pyrimidin-4-yl]oxy-4-methoxy-benzoic acid methyl ester Formula: C22H21N5O8 MolecularWeight: 483.43084

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)OC)OC2=NC=NC(=C2[N+](=O)[O-])N3CCN(CC3)C(=O)C4=CC=CO4

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)OC)OC2=NC=NC(=C2[N+](=O)[O-])N3CCN(CC3)C(=O)C4=CC=CO4

InChI

InChI=1S/C22H21N5O8/c1-32-14-5-6-15(22(29)33-2)17(12-14)35-20-18(27(30)31)19(23-13-24-20)25-7-9-26(10-8-25)21(28)16-4-3-11-34-16/h3-6,11-13H,7-10H2,1-2H3