4-(furan-2-yl)-1-(1-methoxypropyl)-4-methyl-piperidine; 2-oxidanylpropane-1,2,3-tricarboxylate

Systemtic Name: 4-(furan-2-yl)-1-(1-methoxypropyl)-4-methyl-piperidine; 2-oxidanylpropane-1,2,3-tricarboxylate Openeye Name: 4-(2-furyl)-1-(1-methoxypropyl)-4-methyl-piperidine citrate CAS Name: 4-(2-furanyl)-1-(1-methoxypropyl)-4-methylpiperidine; 2-hydroxypropane-1,2,3-tricarboxylate IUPAC Name: 4-(furan-2-yl)-1-(1-methoxypropyl)-4-methylpiperidine; 2-hydroxypropane-1,2,3-tricarboxylate Traditional Name: 4-(2-furyl)-1-(1-methoxypropyl)-4-methyl-piperidine citrate Formula: C20H28NO9-3 MolecularWeight: 426.43762

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Descriptors Computed from Structure

Canonical SMILES:

CCC(N1CCC(CC1)(C)C2=CC=CO2)OC.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O

Isomeric SMILES

CCC(N1CCC(CC1)(C)C2=CC=CO2)OC.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O

InChI

InChI=1S/C14H23NO2.C6H8O7/c1-4-13(16-3)15-9-7-14(2,8-10-15)12-6-5-11-17-12;7-3(8)1-6(13,5(11)12)2-4(9)10/h5-6,11,13H,4,7-10H2,1-3H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/p-3