2-[4-(3,5-diethyl-5-methyl-heptan-3-yl)phenoxy]ethanoate

Systemtic Name: 2-[4-(3,5-diethyl-5-methyl-heptan-3-yl)phenoxy]ethanoate Openeye Name: 2-[4-(1,1,3-triethyl-3-methyl-pentyl)phenoxy]acetate CAS Name: 2-[4-(3,5-diethyl-5-methylheptan-3-yl)phenoxy]acetate IUPAC Name: 2-[4-(3,5-diethyl-5-methylheptan-3-yl)phenoxy]acetate Traditional Name: 2-[4-(1,1,3-triethyl-3-methyl-pentyl)phenoxy]acetate Formula: C20H31O3- MolecularWeight: 319.45834

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(CC)CC(CC)(CC)C1=CC=C(C=C1)OCC(=O)[O-]

Isomeric SMILES

CCC(C)(CC)CC(CC)(CC)C1=CC=C(C=C1)OCC(=O)[O-]

InChI

InChI=1S/C20H32O3/c1-6-19(5,7-2)15-20(8-3,9-4)16-10-12-17(13-11-16)23-14-18(21)22/h10-13H,6-9,14-15H2,1-5H3,(H,21,22)/p-1