2-[4-tert-butyl-2-(piperidin-1-ylmethyl)phenoxy]ethanoic acid

Systemtic Name: 2-[4-tert-butyl-2-(piperidin-1-ylmethyl)phenoxy]ethanoic acid Openeye Name: 2-[4-tert-butyl-2-(1-piperidylmethyl)phenoxy]acetic acid CAS Name: 2-[4-tert-butyl-2-(1-piperidinylmethyl)phenoxy]acetic acid IUPAC Name: 2-[4-tert-butyl-2-(piperidin-1-ylmethyl)phenoxy]acetic acid Traditional Name: 2-[4-tert-butyl-2-(piperidinomethyl)phenoxy]acetic acid Formula: C18H27NO3 MolecularWeight: 305.41188

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)OCC(=O)O)CN2CCCCC2

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)OCC(=O)O)CN2CCCCC2

InChI

InChI=1S/C18H27NO3/c1-18(2,3)15-7-8-16(22-13-17(20)21)14(11-15)12-19-9-5-4-6-10-19/h7-8,11H,4-6,9-10,12-13H2,1-3H3,(H,20,21)