1-[(3-phenylmethoxyphenyl)-(4-phenylphenyl)methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(3-phenylmethoxyphenyl)-(4-phenylphenyl)methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(3-benzyloxyphenyl)-(4-phenylphenyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(3-phenylmethoxyphenyl)-(4-phenylphenyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(3-phenylmethoxyphenyl)-(4-phenylphenyl)methyl]piperidine-4-carboxylic acid Traditional Name: 1-[(3-benzoxyphenyl)-(4-phenylphenyl)methyl]isonipecotic acid Formula: C32H31NO3 MolecularWeight: 477.59344

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C(C2=CC=C(C=C2)C3=CC=CC=C3)C4=CC(=CC=C4)OCC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1C(=O)O)C(C2=CC=C(C=C2)C3=CC=CC=C3)C4=CC(=CC=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C32H31NO3/c34-32(35)28-18-20-33(21-19-28)31(27-16-14-26(15-17-27)25-10-5-2-6-11-25)29-12-7-13-30(22-29)36-23-24-8-3-1-4-9-24/h1-17,22,28,31H,18-21,23H2,(H,34,35)