N-(3,5-dimethoxyphenyl)-2-[2-[4-(furan-2-ylcarbonyl)piperazin-1-yl]ethanoylamino]-5-nitro-benzamide

Systemtic Name: N-(3,5-dimethoxyphenyl)-2-[2-[4-(furan-2-ylcarbonyl)piperazin-1-yl]ethanoylamino]-5-nitro-benzamide Openeye Name: N-(3,5-dimethoxyphenyl)-2-[[2-[4-(furan-2-carbonyl)piperazin-1-yl]acetyl]amino]-5-nitro-benzamide CAS Name: N-(3,5-dimethoxyphenyl)-2-[[2-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-1-oxoethyl]amino]-5-nitrobenzamide IUPAC Name: N-(3,5-dimethoxyphenyl)-2-[[2-[4-(furan-2-carbonyl)piperazin-1-yl]acetyl]amino]-5-nitrobenzamide Traditional Name: N-(3,5-dimethoxyphenyl)-2-[[2-[4-(2-furoyl)piperazino]acetyl]amino]-5-nitro-benzamide Formula: C26H27N5O8 MolecularWeight: 537.52128

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NC(=O)CN3CCN(CC3)C(=O)C4=CC=CO4)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NC(=O)CN3CCN(CC3)C(=O)C4=CC=CO4)OC

InChI

InChI=1S/C26H27N5O8/c1-37-19-12-17(13-20(15-19)38-2)27-25(33)21-14-18(31(35)36)5-6-22(21)28-24(32)16-29-7-9-30(10-8-29)26(34)23-4-3-11-39-23/h3-6,11-15H,7-10,16H2,1-2H3,(H,27,33)(H,28,32)