N-(2-fluorophenyl)-2-[2-[4-(furan-2-ylcarbonyl)piperazin-1-ium-1-yl]ethanoylamino]-5-nitro-benzamide

Systemtic Name: N-(2-fluorophenyl)-2-[2-[4-(furan-2-ylcarbonyl)piperazin-1-ium-1-yl]ethanoylamino]-5-nitro-benzamide Openeye Name: N-(2-fluorophenyl)-2-[[2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]acetyl]amino]-5-nitro-benzamide CAS Name: N-(2-fluorophenyl)-2-[[2-[4-[2-furanyl(oxo)methyl]-1-piperazin-1-iumyl]-1-oxoethyl]amino]-5-nitrobenzamide IUPAC Name: N-(2-fluorophenyl)-2-[[2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]acetyl]amino]-5-nitrobenzamide Traditional Name: N-(2-fluorophenyl)-2-[[2-[4-(2-furoyl)piperazin-1-ium-1-yl]acetyl]amino]-5-nitro-benzamide Formula: C24H23FN5O6+ MolecularWeight: 496.467723

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC=CC=C3F)C(=O)C4=CC=CO4

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC=CC=C3F)C(=O)C4=CC=CO4

InChI

InChI=1S/C24H22FN5O6/c25-18-4-1-2-5-20(18)27-23(32)17-14-16(30(34)35)7-8-19(17)26-22(31)15-28-9-11-29(12-10-28)24(33)21-6-3-13-36-21/h1-8,13-14H,9-12,15H2,(H,26,31)(H,27,32)/p+1