2-[2,4-bis(2-methylbutan-2-yl)phenoxy]butanoate

Systemtic Name: 2-[2,4-bis(2-methylbutan-2-yl)phenoxy]butanoate Openeye Name: 2-[2,4-bis(1,1-dimethylpropyl)phenoxy]butanoate CAS Name: 2-[2,4-bis(2-methylbutan-2-yl)phenoxy]butanoate IUPAC Name: 2-[2,4-bis(2-methylbutan-2-yl)phenoxy]butanoate Traditional Name: 2-(2,4-ditert-amylphenoxy)butyrate Formula: C20H31O3- MolecularWeight: 319.45834

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)[O-])OC1=C(C=C(C=C1)C(C)(C)CC)C(C)(C)CC

Isomeric SMILES

CCC(C(=O)[O-])OC1=C(C=C(C=C1)C(C)(C)CC)C(C)(C)CC

InChI

InChI=1S/C20H32O3/c1-8-16(18(21)22)23-17-12-11-14(19(4,5)9-2)13-15(17)20(6,7)10-3/h11-13,16H,8-10H2,1-7H3,(H,21,22)/p-1