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

Systemtic Name: azanium phenyl 1-(3,3-diphenyl-3-pyridin-2-yl-propyl)piperidine-4-carboxylate Openeye Name: ammonium phenyl 1-[3,3-diphenyl-3-(2-pyridyl)propyl]piperidine-4-carboxylate CAS Name: ammonium 1-[3,3-diphenyl-3-(2-pyridinyl)propyl]-4-piperidinecarboxylic acid phenyl ester IUPAC Name: azanium phenyl 1-(3,3-diphenyl-3-pyridin-2-ylpropyl)piperidine-4-carboxylate Traditional Name: ammonium 1-[3,3-diphenyl-3-(2-pyridyl)propyl]isonipecotic acid phenyl ester Formula: C32H36N3O2+ MolecularWeight: 494.64714

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OC2=CC=CC=C2)CCC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=N5.[NH4+]

Isomeric SMILES

C1CN(CCC1C(=O)OC2=CC=CC=C2)CCC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=N5.[NH4+]

InChI

InChI=1S/C32H32N2O2.H3N/c35-31(36-29-16-8-3-9-17-29)26-19-23-34(24-20-26)25-21-32(27-12-4-1-5-13-27,28-14-6-2-7-15-28)30-18-10-11-22-33-30;/h1-18,22,26H,19-21,23-25H2;1H3/p+1