methyl 5-[[4-[(5-methoxycarbonylfuran-2-yl)methyl]piperazin-1-ium-1-yl]methyl]furan-2-carboxylate

Systemtic Name: methyl 5-[[4-[(5-methoxycarbonylfuran-2-yl)methyl]piperazin-1-ium-1-yl]methyl]furan-2-carboxylate Openeye Name: methyl 5-[[4-[(5-methoxycarbonyl-2-furyl)methyl]piperazin-1-ium-1-yl]methyl]furan-2-carboxylate CAS Name: 5-[[4-[(5-methoxycarbonyl-2-furanyl)methyl]-1-piperazin-1-iumyl]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[4-[(5-methoxycarbonylfuran-2-yl)methyl]piperazin-1-ium-1-yl]methyl]furan-2-carboxylate Traditional Name: 5-[[4-[(5-carbomethoxy-2-furyl)methyl]piperazin-1-ium-1-yl]methyl]furan-2-carboxylic acid methyl ester Formula: C18H23N2O6+ MolecularWeight: 363.38502

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(O1)C[NH+]2CCN(CC2)CC3=CC=C(O3)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC=C(O1)C[NH+]2CCN(CC2)CC3=CC=C(O3)C(=O)OC

InChI

InChI=1S/C18H22N2O6/c1-23-17(21)15-5-3-13(25-15)11-19-7-9-20(10-8-19)12-14-4-6-16(26-14)18(22)24-2/h3-6H,7-12H2,1-2H3/p+1