1-[(3-phenoxyphenyl)-phenyl-methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(3-phenoxyphenyl)-phenyl-methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(3-phenoxyphenyl)-phenyl-methyl]piperidine-4-carboxylic acid CAS Name: 1-[(3-phenoxyphenyl)-phenylmethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(3-phenoxyphenyl)-phenylmethyl]piperidine-4-carboxylic acid Traditional Name: 1-[(3-phenoxyphenyl)-phenyl-methyl]isonipecotic acid Formula: C25H25NO3 MolecularWeight: 387.4709

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C(C2=CC=CC=C2)C3=CC(=CC=C3)OC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)O)C(C2=CC=CC=C2)C3=CC(=CC=C3)OC4=CC=CC=C4

InChI

InChI=1S/C25H25NO3/c27-25(28)20-14-16-26(17-15-20)24(19-8-3-1-4-9-19)21-10-7-13-23(18-21)29-22-11-5-2-6-12-22/h1-13,18,20,24H,14-17H2,(H,27,28)