2-oxidanylpropane-1,2,3-tricarboxylate; 1-(2-phenoxyethyl)-3-(pyrrolidin-1-ylmethyl)piperidine

Systemtic Name: 2-oxidanylpropane-1,2,3-tricarboxylate; 1-(2-phenoxyethyl)-3-(pyrrolidin-1-ylmethyl)piperidine Openeye Name: 1-(2-phenoxyethyl)-3-(pyrrolidin-1-ylmethyl)piperidine citrate CAS Name: 2-hydroxypropane-1,2,3-tricarboxylate; 1-(2-phenoxyethyl)-3-(1-pyrrolidinylmethyl)piperidine IUPAC Name: 2-hydroxypropane-1,2,3-tricarboxylate; 1-(2-phenoxyethyl)-3-(pyrrolidin-1-ylmethyl)piperidine Traditional Name: 1-(2-phenoxyethyl)-3-(pyrrolidinomethyl)piperidine citrate Formula: C24H33N2O8-3 MolecularWeight: 477.52742

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2CCCN(C2)CCOC3=CC=CC=C3.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O

Isomeric SMILES

C1CCN(C1)CC2CCCN(C2)CCOC3=CC=CC=C3.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O

InChI

InChI=1S/C18H28N2O.C6H8O7/c1-2-8-18(9-3-1)21-14-13-20-12-6-7-17(16-20)15-19-10-4-5-11-19;7-3(8)1-6(13,5(11)12)2-4(9)10/h1-3,8-9,17H,4-7,10-16H2;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/p-3