4-[2-[4-(furan-2-ylcarbonyl)piperazin-1-ium-1-yl]ethanoylamino]benzamide

Systemtic Name: 4-[2-[4-(furan-2-ylcarbonyl)piperazin-1-ium-1-yl]ethanoylamino]benzamide Openeye Name: 4-[[2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]acetyl]amino]benzamide CAS Name: 4-[[2-[4-[2-furanyl(oxo)methyl]-1-piperazin-1-iumyl]-1-oxoethyl]amino]benzamide IUPAC Name: 4-[[2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]acetyl]amino]benzamide Traditional Name: 4-[[2-[4-(2-furoyl)piperazin-1-ium-1-yl]acetyl]amino]benzamide Formula: C18H21N4O4+ MolecularWeight: 357.38374

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC2=CC=C(C=C2)C(=O)N)C(=O)C3=CC=CO3

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2=CC=C(C=C2)C(=O)N)C(=O)C3=CC=CO3

InChI

InChI=1S/C18H20N4O4/c19-17(24)13-3-5-14(6-4-13)20-16(23)12-21-7-9-22(10-8-21)18(25)15-2-1-11-26-15/h1-6,11H,7-10,12H2,(H2,19,24)(H,20,23)/p+1