3-[4-[[4-[(4-phenylpiperidin-1-yl)methyl]phenyl]methoxy]phenyl]propanoic acid

Systemtic Name: 3-[4-[[4-[(4-phenylpiperidin-1-yl)methyl]phenyl]methoxy]phenyl]propanoic acid Openeye Name: 3-[4-[[4-[(4-phenyl-1-piperidyl)methyl]phenyl]methoxy]phenyl]propanoic acid CAS Name: 3-[4-[[4-[(4-phenyl-1-piperidinyl)methyl]phenyl]methoxy]phenyl]propanoic acid IUPAC Name: 3-[4-[[4-[(4-phenylpiperidin-1-yl)methyl]phenyl]methoxy]phenyl]propanoic acid Traditional Name: 3-[4-[4-[(4-phenylpiperidino)methyl]benzyl]oxyphenyl]propionic acid Formula: C28H31NO3 MolecularWeight: 429.55064

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=CC=CC=C2)CC3=CC=C(C=C3)COC4=CC=C(C=C4)CCC(=O)O

Isomeric SMILES

C1CN(CCC1C2=CC=CC=C2)CC3=CC=C(C=C3)COC4=CC=C(C=C4)CCC(=O)O

InChI

InChI=1S/C28H31NO3/c30-28(31)15-12-22-10-13-27(14-11-22)32-21-24-8-6-23(7-9-24)20-29-18-16-26(17-19-29)25-4-2-1-3-5-25/h1-11,13-14,26H,12,15-21H2,(H,30,31)