ethyl (E)-3-[3-(2-butoxy-3,5-ditert-butyl-phenyl)-4-oxidanyl-phenyl]prop-2-enoate

Systemtic Name: ethyl (E)-3-[3-(2-butoxy-3,5-ditert-butyl-phenyl)-4-oxidanyl-phenyl]prop-2-enoate Openeye Name: ethyl (E)-3-[3-(2-butoxy-3,5-ditert-butyl-phenyl)-4-hydroxy-phenyl]prop-2-enoate CAS Name: (E)-3-[3-(2-butoxy-3,5-ditert-butylphenyl)-4-hydroxyphenyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[3-(2-butoxy-3,5-ditert-butylphenyl)-4-hydroxyphenyl]prop-2-enoate Traditional Name: (E)-3-[3-(2-butoxy-3,5-ditert-butyl-phenyl)-4-hydroxy-phenyl]acrylic acid ethyl ester Formula: C29H40O4 MolecularWeight: 452.6255

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1C2=C(C=CC(=C2)C=CC(=O)OCC)O)C(C)(C)C)C(C)(C)C

Isomeric SMILES

CCCCOC1=C(C=C(C=C1C2=C(C=CC(=C2)/C=C/C(=O)OCC)O)C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C29H40O4/c1-9-11-16-33-27-23(18-21(28(3,4)5)19-24(27)29(6,7)8)22-17-20(12-14-25(22)30)13-15-26(31)32-10-2/h12-15,17-19,30H,9-11,16H2,1-8H3/b15-13+