1-[4-[6-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-5-nitro-pyrimidin-4-yl]oxy-3-prop-2-enyl-phenyl]ethanone

Systemtic Name: 1-[4-[6-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-5-nitro-pyrimidin-4-yl]oxy-3-prop-2-enyl-phenyl]ethanone Openeye Name: 1-[3-allyl-4-[6-[4-(furan-2-carbonyl)piperazin-1-yl]-5-nitro-pyrimidin-4-yl]oxy-phenyl]ethanone CAS Name: 1-[4-[[6-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-5-nitro-4-pyrimidinyl]oxy]-3-prop-2-enylphenyl]ethanone IUPAC Name: 1-[4-[6-[4-(furan-2-carbonyl)piperazin-1-yl]-5-nitropyrimidin-4-yl]oxy-3-prop-2-enylphenyl]ethanone Traditional Name: 1-[3-allyl-4-[6-[4-(2-furoyl)piperazino]-5-nitro-pyrimidin-4-yl]oxy-phenyl]ethanone Formula: C24H23N5O6 MolecularWeight: 477.46932

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H23N5O6/c1-3-5-18-14-17(16(2)30)7-8-19(18)35-23-21(29(32)33)22(25-15-26-23)27-9-11-28(12-10-27)24(31)20-6-4-13-34-20/h3-4,6-8,13-15H,1,5,9-12H2,2H3