4-[4-[6-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-5-nitro-pyrimidin-4-yl]oxy-3-methoxy-phenyl]butan-2-one

Systemtic Name: 4-[4-[6-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-5-nitro-pyrimidin-4-yl]oxy-3-methoxy-phenyl]butan-2-one Openeye Name: 4-[4-[6-[4-(furan-2-carbonyl)piperazin-1-yl]-5-nitro-pyrimidin-4-yl]oxy-3-methoxy-phenyl]butan-2-one CAS Name: 4-[4-[[6-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-5-nitro-4-pyrimidinyl]oxy]-3-methoxyphenyl]-2-butanone IUPAC Name: 4-[4-[6-[4-(furan-2-carbonyl)piperazin-1-yl]-5-nitropyrimidin-4-yl]oxy-3-methoxyphenyl]butan-2-one Traditional Name: 4-[4-[6-[4-(2-furoyl)piperazino]-5-nitro-pyrimidin-4-yl]oxy-3-methoxy-phenyl]butan-2-one Formula: C24H25N5O7 MolecularWeight: 495.4846

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC1=CC(=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])N3CCN(CC3)C(=O)C4=CC=CO4)OC

Isomeric SMILES

CC(=O)CCC1=CC(=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])N3CCN(CC3)C(=O)C4=CC=CO4)OC

InChI

InChI=1S/C24H25N5O7/c1-16(30)5-6-17-7-8-18(20(14-17)34-2)36-23-21(29(32)33)22(25-15-26-23)27-9-11-28(12-10-27)24(31)19-4-3-13-35-19/h3-4,7-8,13-15H,5-6,9-12H2,1-2H3