methyl 4-(4-fluorophenyl)-1-methyl-piperidine-3-carboxylate; oxidanylmethanetricarboxylic acid

Systemtic Name: methyl 4-(4-fluorophenyl)-1-methyl-piperidine-3-carboxylate; oxidanylmethanetricarboxylic acid Openeye Name: hydroxymethanetricarboxylic acid; methyl 4-(4-fluorophenyl)-1-methyl-piperidine-3-carboxylate CAS Name: 4-(4-fluorophenyl)-1-methyl-3-piperidinecarboxylic acid methyl ester; hydroxymethanetricarboxylic acid IUPAC Name: hydroxymethanetricarboxylic acid; methyl 4-(4-fluorophenyl)-1-methylpiperidine-3-carboxylate Traditional Name: 4-(4-fluorophenyl)-1-methyl-nipecotic acid methyl ester; hydroxymethanetricarboxylic acid Formula: C18H22FNO9 MolecularWeight: 415.366983

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(C(C1)C(=O)OC)C2=CC=C(C=C2)F.C(=O)(C(C(=O)O)(C(=O)O)O)O

Isomeric SMILES

CN1CCC(C(C1)C(=O)OC)C2=CC=C(C=C2)F.C(=O)(C(C(=O)O)(C(=O)O)O)O

InChI

InChI=1S/C14H18FNO2.C4H4O7/c1-16-8-7-12(13(9-16)14(17)18-2)10-3-5-11(15)6-4-10;5-1(6)4(11,2(7)8)3(9)10/h3-6,12-13H,7-9H2,1-2H3;11H,(H,5,6)(H,7,8)(H,9,10)