methyl (2R)-2-(2-chlorophenyl)-2-[4-(furan-3-ylcarbonyl)piperazin-1-ium-1-yl]ethanoate

Systemtic Name: methyl (2R)-2-(2-chlorophenyl)-2-[4-(furan-3-ylcarbonyl)piperazin-1-ium-1-yl]ethanoate Openeye Name: methyl (2R)-2-(2-chlorophenyl)-2-[4-(furan-3-carbonyl)piperazin-1-ium-1-yl]acetate CAS Name: (2R)-2-(2-chlorophenyl)-2-[4-[3-furanyl(oxo)methyl]-1-piperazin-1-iumyl]acetic acid methyl ester IUPAC Name: methyl (2R)-2-(2-chlorophenyl)-2-[4-(furan-3-carbonyl)piperazin-1-ium-1-yl]acetate Traditional Name: (2R)-2-(2-chlorophenyl)-2-[4-(3-furoyl)piperazin-1-ium-1-yl]acetic acid methyl ester Formula: C18H20ClN2O4+ MolecularWeight: 363.8154

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=CC=C1Cl)[NH+]2CCN(CC2)C(=O)C3=COC=C3

Isomeric SMILES

COC(=O)[C@@H](C1=CC=CC=C1Cl)[NH+]2CCN(CC2)C(=O)C3=COC=C3

InChI

InChI=1S/C18H19ClN2O4/c1-24-18(23)16(14-4-2-3-5-15(14)19)20-7-9-21(10-8-20)17(22)13-6-11-25-12-13/h2-6,11-12,16H,7-10H2,1H3/p+1/t16-/m1/s1