2,2,21,21-tetramethyldocosan-3-yl 3-(3-hydroxyphenyl)propanoate

Systemtic Name: 2,2,21,21-tetramethyldocosan-3-yl 3-(3-hydroxyphenyl)propanoate Openeye Name: (1-tert-butyl-19,19-dimethyl-icosyl) 3-(3-hydroxyphenyl)propanoate CAS Name: 3-(3-hydroxyphenyl)propanoic acid 2,2,21,21-tetramethyldocosan-3-yl ester IUPAC Name: 2,2,21,21-tetramethyldocosan-3-yl 3-(3-hydroxyphenyl)propanoate Traditional Name: 3-(3-hydroxyphenyl)propionic acid (1-tert-butyl-19,19-dimethyl-eicosyl) ester Formula: C35H62O3 MolecularWeight: 530.86498

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CCCCCCCCCCCCCCCCCC(C(C)(C)C)OC(=O)CCC1=CC(=CC=C1)O

Isomeric SMILES

CC(C)(C)CCCCCCCCCCCCCCCCCC(C(C)(C)C)OC(=O)CCC1=CC(=CC=C1)O

InChI

InChI=1S/C35H62O3/c1-34(2,3)28-21-19-17-15-13-11-9-7-8-10-12-14-16-18-20-25-32(35(4,5)6)38-33(37)27-26-30-23-22-24-31(36)29-30/h22-24,29,32,36H,7-21,25-28H2,1-6H3