ethyl (E)-3-[3-(2-methylbutan-2-yl)-5-(2-methylhexan-2-yl)-4-oxidanyl-phenyl]prop-2-enoate

Systemtic Name: ethyl (E)-3-[3-(2-methylbutan-2-yl)-5-(2-methylhexan-2-yl)-4-oxidanyl-phenyl]prop-2-enoate Openeye Name: ethyl (E)-3-[3-(1,1-dimethylpentyl)-5-(1,1-dimethylpropyl)-4-hydroxy-phenyl]prop-2-enoate CAS Name: (E)-3-[4-hydroxy-3-(2-methylbutan-2-yl)-5-(2-methylhexan-2-yl)phenyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[4-hydroxy-3-(2-methylbutan-2-yl)-5-(2-methylhexan-2-yl)phenyl]prop-2-enoate Traditional Name: (E)-3-[3-tert-amyl-5-(1,1-dimethylpentyl)-4-hydroxy-phenyl]acrylic acid ethyl ester Formula: C23H36O3 MolecularWeight: 360.53014

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)(C)C1=CC(=CC(=C1O)C(C)(C)CC)C=CC(=O)OCC

Isomeric SMILES

CCCCC(C)(C)C1=CC(=CC(=C1O)C(C)(C)CC)/C=C/C(=O)OCC

InChI

InChI=1S/C23H36O3/c1-8-11-14-23(6,7)19-16-17(12-13-20(24)26-10-3)15-18(21(19)25)22(4,5)9-2/h12-13,15-16,25H,8-11,14H2,1-7H3/b13-12+