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

Systemtic Name: 1-[(3-chlorophenyl)-(3-phenoxyphenyl)methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(3-chlorophenyl)-(3-phenoxyphenyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(3-chlorophenyl)-(3-phenoxyphenyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(3-chlorophenyl)-(3-phenoxyphenyl)methyl]piperidine-4-carboxylic acid Traditional Name: 1-[(3-chlorophenyl)-(3-phenoxyphenyl)methyl]isonipecotic acid Formula: C25H24ClNO3 MolecularWeight: 421.91596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C(C2=CC(=CC=C2)OC3=CC=CC=C3)C4=CC(=CC=C4)Cl

Isomeric SMILES

C1CN(CCC1C(=O)O)C(C2=CC(=CC=C2)OC3=CC=CC=C3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C25H24ClNO3/c26-21-8-4-6-19(16-21)24(27-14-12-18(13-15-27)25(28)29)20-7-5-11-23(17-20)30-22-9-2-1-3-10-22/h1-11,16-18,24H,12-15H2,(H,28,29)