1-[naphthalen-1-yl-(3-phenoxyphenyl)methyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[naphthalen-1-yl-(3-phenoxyphenyl)methyl]piperidine-3-carboxylic acid Openeye Name: 1-[1-naphthyl-(3-phenoxyphenyl)methyl]piperidine-3-carboxylic acid CAS Name: 1-[1-naphthalenyl-(3-phenoxyphenyl)methyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[naphthalen-1-yl-(3-phenoxyphenyl)methyl]piperidine-3-carboxylic acid Traditional Name: 1-[1-naphthyl-(3-phenoxyphenyl)methyl]nipecotic acid Formula: C29H27NO3 MolecularWeight: 437.52958

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(C2=CC(=CC=C2)OC3=CC=CC=C3)C4=CC=CC5=CC=CC=C54)C(=O)O

Isomeric SMILES

C1CC(CN(C1)C(C2=CC(=CC=C2)OC3=CC=CC=C3)C4=CC=CC5=CC=CC=C54)C(=O)O

InChI

InChI=1S/C29H27NO3/c31-29(32)23-12-8-18-30(20-23)28(27-17-7-10-21-9-4-5-16-26(21)27)22-11-6-15-25(19-22)33-24-13-2-1-3-14-24/h1-7,9-11,13-17,19,23,28H,8,12,18,20H2,(H,31,32)