2-[4-(2-methylicosan-2-yl)phenoxy]ethanoic acid

Systemtic Name: 2-[4-(2-methylicosan-2-yl)phenoxy]ethanoic acid Openeye Name: 2-[4-(1,1-dimethylnonadecyl)phenoxy]acetic acid CAS Name: 2-[4-(2-methyleicosan-2-yl)phenoxy]acetic acid IUPAC Name: 2-[4-(2-methylicosan-2-yl)phenoxy]acetic acid Traditional Name: 2-[4-(1,1-dimethylnonadecyl)phenoxy]acetic acid Formula: C29H50O3 MolecularWeight: 446.7055

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H50O3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-24-29(2,3)26-20-22-27(23-21-26)32-25-28(30)31/h20-23H,4-19,24-25H2,1-3H3,(H,30,31)