[4-hexadecoxy-3-(2,4,4-trimethylpentan-2-yl)phenyl] 2,2-dimethylpropanoate

Systemtic Name: [4-hexadecoxy-3-(2,4,4-trimethylpentan-2-yl)phenyl] 2,2-dimethylpropanoate Openeye Name: [4-hexadecoxy-3-(1,1,3,3-tetramethylbutyl)phenyl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [4-hexadecoxy-3-(2,4,4-trimethylpentan-2-yl)phenyl] ester IUPAC Name: [4-hexadecoxy-3-(2,4,4-trimethylpentan-2-yl)phenyl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [4-cetyloxy-3-(1,1,3,3-tetramethylbutyl)phenyl] ester Formula: C35H62O3 MolecularWeight: 530.86498

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1=C(C=C(C=C1)OC(=O)C(C)(C)C)C(C)(C)CC(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCOC1=C(C=C(C=C1)OC(=O)C(C)(C)C)C(C)(C)CC(C)(C)C

InChI

InChI=1S/C35H62O3/c1-10-11-12-13-14-15-16-17-18-19-20-21-22-23-26-37-31-25-24-29(38-32(36)34(5,6)7)27-30(31)35(8,9)28-33(2,3)4/h24-25,27H,10-23,26,28H2,1-9H3