N'-(4-ethoxyphenyl)-N-[2-[4-(furan-2-ylcarbonyl)piperazin-1-ium-1-yl]ethyl]ethanediamide

Systemtic Name: N'-(4-ethoxyphenyl)-N-[2-[4-(furan-2-ylcarbonyl)piperazin-1-ium-1-yl]ethyl]ethanediamide Openeye Name: N'-(4-ethoxyphenyl)-N-[2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]ethyl]oxamide CAS Name: N'-(4-ethoxyphenyl)-N-[2-[4-[2-furanyl(oxo)methyl]-1-piperazin-1-iumyl]ethyl]oxamide IUPAC Name: N'-(4-ethoxyphenyl)-N-[2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]ethyl]oxamide Traditional Name: N-[2-[4-(2-furoyl)piperazin-1-ium-1-yl]ethyl]-N'-p-phenetyl-oxamide Formula: C21H27N4O5+ MolecularWeight: 415.46288

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C(=O)NCC[NH+]2CCN(CC2)C(=O)C3=CC=CO3

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)C(=O)NCC[NH+]2CCN(CC2)C(=O)C3=CC=CO3

InChI

InChI=1S/C21H26N4O5/c1-2-29-17-7-5-16(6-8-17)23-20(27)19(26)22-9-10-24-11-13-25(14-12-24)21(28)18-4-3-15-30-18/h3-8,15H,2,9-14H2,1H3,(H,22,26)(H,23,27)/p+1