N-(3-chloranyl-2-methyl-phenyl)-2-[2-[4-(furan-2-ylcarbonyl)piperazin-1-ium-1-yl]ethanoylamino]ethanamide

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-2-[2-[4-(furan-2-ylcarbonyl)piperazin-1-ium-1-yl]ethanoylamino]ethanamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-2-[[2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]acetyl]amino]acetamide CAS Name: N-(3-chloro-2-methylphenyl)-2-[[2-[4-[2-furanyl(oxo)methyl]-1-piperazin-1-iumyl]-1-oxoethyl]amino]acetamide IUPAC Name: N-(3-chloro-2-methylphenyl)-2-[[2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]acetyl]amino]acetamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-2-[[2-[4-(2-furoyl)piperazin-1-ium-1-yl]acetyl]amino]acetamide Formula: C20H24ClN4O4+ MolecularWeight: 419.88196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)CNC(=O)C[NH+]2CCN(CC2)C(=O)C3=CC=CO3

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)CNC(=O)C[NH+]2CCN(CC2)C(=O)C3=CC=CO3

InChI

InChI=1S/C20H23ClN4O4/c1-14-15(21)4-2-5-16(14)23-18(26)12-22-19(27)13-24-7-9-25(10-8-24)20(28)17-6-3-11-29-17/h2-6,11H,7-10,12-13H2,1H3,(H,22,27)(H,23,26)/p+1