methyl (E)-3-[3,5-bis(2-methylpentan-2-yl)-4-oxidanyl-phenyl]prop-2-enoate

Systemtic Name: methyl (E)-3-[3,5-bis(2-methylpentan-2-yl)-4-oxidanyl-phenyl]prop-2-enoate Openeye Name: methyl (E)-3-[3,5-bis(1,1-dimethylbutyl)-4-hydroxy-phenyl]prop-2-enoate CAS Name: (E)-3-[4-hydroxy-3,5-bis(2-methylpentan-2-yl)phenyl]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-[4-hydroxy-3,5-bis(2-methylpentan-2-yl)phenyl]prop-2-enoate Traditional Name: (E)-3-[3,5-bis(1,1-dimethylbutyl)-4-hydroxy-phenyl]acrylic acid methyl ester Formula: C22H34O3 MolecularWeight: 346.50356

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(C)C1=CC(=CC(=C1O)C(C)(C)CCC)C=CC(=O)OC

Isomeric SMILES

CCCC(C)(C)C1=CC(=CC(=C1O)C(C)(C)CCC)/C=C/C(=O)OC

InChI

InChI=1S/C22H34O3/c1-8-12-21(3,4)17-14-16(10-11-19(23)25-7)15-18(20(17)24)22(5,6)13-9-2/h10-11,14-15,24H,8-9,12-13H2,1-7H3/b11-10+