N-ethyl-3-[2-[4-(furan-2-ylcarbonyl)piperazin-1-ium-1-yl]ethanoylamino]benzamide

Systemtic Name: N-ethyl-3-[2-[4-(furan-2-ylcarbonyl)piperazin-1-ium-1-yl]ethanoylamino]benzamide Openeye Name: N-ethyl-3-[[2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]acetyl]amino]benzamide CAS Name: N-ethyl-3-[[2-[4-[2-furanyl(oxo)methyl]-1-piperazin-1-iumyl]-1-oxoethyl]amino]benzamide IUPAC Name: N-ethyl-3-[[2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]acetyl]amino]benzamide Traditional Name: N-ethyl-3-[[2-[4-(2-furoyl)piperazin-1-ium-1-yl]acetyl]amino]benzamide Formula: C20H25N4O4+ MolecularWeight: 385.4369

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CC(=CC=C1)NC(=O)C[NH+]2CCN(CC2)C(=O)C3=CC=CO3

Isomeric SMILES

CCNC(=O)C1=CC(=CC=C1)NC(=O)C[NH+]2CCN(CC2)C(=O)C3=CC=CO3

InChI

InChI=1S/C20H24N4O4/c1-2-21-19(26)15-5-3-6-16(13-15)22-18(25)14-23-8-10-24(11-9-23)20(27)17-7-4-12-28-17/h3-7,12-13H,2,8-11,14H2,1H3,(H,21,26)(H,22,25)/p+1