methyl 3-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]propanoate

Systemtic Name: methyl 3-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]propanoate Openeye Name: methyl 3-[4-(1,1,3,3-tetramethylbutyl)phenoxy]propanoate CAS Name: 3-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]propanoic acid methyl ester IUPAC Name: methyl 3-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]propanoate Traditional Name: 3-[4-(1,1,3,3-tetramethylbutyl)phenoxy]propionic acid methyl ester Formula: C18H28O3 MolecularWeight: 292.41312

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C)(C)C1=CC=C(C=C1)OCCC(=O)OC

Isomeric SMILES

CC(C)(C)CC(C)(C)C1=CC=C(C=C1)OCCC(=O)OC

InChI

InChI=1S/C18H28O3/c1-17(2,3)13-18(4,5)14-7-9-15(10-8-14)21-12-11-16(19)20-6/h7-10H,11-13H2,1-6H3