sodium 1-(3,3-diphenyl-3-pyridin-2-yl-propyl)-4-phenyl-piperidine-4-carboxylate

Systemtic Name: sodium 1-(3,3-diphenyl-3-pyridin-2-yl-propyl)-4-phenyl-piperidine-4-carboxylate Openeye Name: sodium 1-[3,3-diphenyl-3-(2-pyridyl)propyl]-4-phenyl-piperidine-4-carboxylate CAS Name: sodium 1-[3,3-diphenyl-3-(2-pyridinyl)propyl]-4-phenyl-4-piperidinecarboxylate IUPAC Name: sodium 1-(3,3-diphenyl-3-pyridin-2-ylpropyl)-4-phenylpiperidine-4-carboxylate Traditional Name: sodium 1-[3,3-diphenyl-3-(2-pyridyl)propyl]-4-phenyl-isonipecotate Formula: C32H31N2NaO2 MolecularWeight: 498.59051

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC=CC=C2)C(=O)[O-])CCC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=N5.[Na+]

Isomeric SMILES

C1CN(CCC1(C2=CC=CC=C2)C(=O)[O-])CCC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=N5.[Na+]

InChI

InChI=1S/C32H32N2O2.Na/c35-30(36)31(26-12-4-1-5-13-26)19-23-34(24-20-31)25-21-32(27-14-6-2-7-15-27,28-16-8-3-9-17-28)29-18-10-11-22-33-29;/h1-18,22H,19-21,23-25H2,(H,35,36);/q;+1/p-1