3-[3-tert-butyl-4-oxidanyl-5-[phenyl(piperidin-1-yl)methyl]phenyl]propanoic acid

Systemtic Name: 3-[3-tert-butyl-4-oxidanyl-5-[phenyl(piperidin-1-yl)methyl]phenyl]propanoic acid Openeye Name: 3-[3-tert-butyl-4-hydroxy-5-[phenyl(1-piperidyl)methyl]phenyl]propanoic acid CAS Name: 3-[3-tert-butyl-4-hydroxy-5-[phenyl(1-piperidinyl)methyl]phenyl]propanoic acid IUPAC Name: 3-[3-tert-butyl-4-hydroxy-5-[phenyl(piperidin-1-yl)methyl]phenyl]propanoic acid Traditional Name: 3-[3-tert-butyl-4-hydroxy-5-[phenyl(piperidino)methyl]phenyl]propionic acid Formula: C25H33NO3 MolecularWeight: 395.53442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C2=CC=CC=C2)N3CCCCC3)CCC(=O)O

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C2=CC=CC=C2)N3CCCCC3)CCC(=O)O

InChI

InChI=1S/C25H33NO3/c1-25(2,3)21-17-18(12-13-22(27)28)16-20(24(21)29)23(19-10-6-4-7-11-19)26-14-8-5-9-15-26/h4,6-7,10-11,16-17,23,29H,5,8-9,12-15H2,1-3H3,(H,27,28)