methyl 5-[[4-[(4,5-dimethoxy-2-methyl-phenyl)methyl]piperazine-1,4-diium-1-yl]methyl]-2-methyl-furan-3-carboxylate

Systemtic Name: methyl 5-[[4-[(4,5-dimethoxy-2-methyl-phenyl)methyl]piperazine-1,4-diium-1-yl]methyl]-2-methyl-furan-3-carboxylate Openeye Name: methyl 5-[[4-[(4,5-dimethoxy-2-methyl-phenyl)methyl]piperazine-1,4-diium-1-yl]methyl]-2-methyl-furan-3-carboxylate CAS Name: 5-[[4-[(4,5-dimethoxy-2-methylphenyl)methyl]-1-piperazine-1,4-diiumyl]methyl]-2-methyl-3-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[4-[(4,5-dimethoxy-2-methylphenyl)methyl]piperazine-1,4-diium-1-yl]methyl]-2-methylfuran-3-carboxylate Traditional Name: 5-[[4-(4,5-dimethoxy-2-methyl-benzyl)piperazine-1,4-diium-1-yl]methyl]-2-methyl-furan-3-carboxylic acid methyl ester Formula: C22H32N2O5+2 MolecularWeight: 404.49988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C[NH+]2CC[NH+](CC2)CC3=CC(=C(O3)C)C(=O)OC)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1C[NH+]2CC[NH+](CC2)CC3=CC(=C(O3)C)C(=O)OC)OC)OC

InChI

InChI=1S/C22H30N2O5/c1-15-10-20(26-3)21(27-4)11-17(15)13-23-6-8-24(9-7-23)14-18-12-19(16(2)29-18)22(25)28-5/h10-12H,6-9,13-14H2,1-5H3/p+2