2-methyl-2-[3-[1-(2,4,6-trimethylphenyl)carbonylpiperidin-4-yl]phenoxy]propanoic acid

Systemtic Name: 2-methyl-2-[3-[1-(2,4,6-trimethylphenyl)carbonylpiperidin-4-yl]phenoxy]propanoic acid Openeye Name: 2-methyl-2-[3-[1-(2,4,6-trimethylbenzoyl)-4-piperidyl]phenoxy]propanoic acid CAS Name: 2-methyl-2-[3-[1-[oxo-(2,4,6-trimethylphenyl)methyl]-4-piperidinyl]phenoxy]propanoic acid IUPAC Name: 2-methyl-2-[3-[1-(2,4,6-trimethylbenzoyl)piperidin-4-yl]phenoxy]propanoic acid Traditional Name: 2-methyl-2-[3-[1-(2,4,6-trimethylbenzoyl)-4-piperidyl]phenoxy]propionic acid Formula: C25H31NO4 MolecularWeight: 409.51794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C(=O)N2CCC(CC2)C3=CC(=CC=C3)OC(C)(C)C(=O)O)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C(=O)N2CCC(CC2)C3=CC(=CC=C3)OC(C)(C)C(=O)O)C

InChI

InChI=1S/C25H31NO4/c1-16-13-17(2)22(18(3)14-16)23(27)26-11-9-19(10-12-26)20-7-6-8-21(15-20)30-25(4,5)24(28)29/h6-8,13-15,19H,9-12H2,1-5H3,(H,28,29)