6-methylheptyl (E)-3-(3,5-ditert-butyl-4-oxidanyl-phenyl)prop-2-enoate

Systemtic Name: 6-methylheptyl (E)-3-(3,5-ditert-butyl-4-oxidanyl-phenyl)prop-2-enoate Openeye Name: 6-methylheptyl (E)-3-(3,5-ditert-butyl-4-hydroxy-phenyl)prop-2-enoate CAS Name: (E)-3-(3,5-ditert-butyl-4-hydroxyphenyl)-2-propenoic acid 6-methylheptyl ester IUPAC Name: 6-methylheptyl (E)-3-(3,5-ditert-butyl-4-hydroxyphenyl)prop-2-enoate Traditional Name: (E)-3-(3,5-ditert-butyl-4-hydroxy-phenyl)acrylic acid 6-methylheptyl ester Formula: C25H40O3 MolecularWeight: 388.5833

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCOC(=O)C=CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C

Isomeric SMILES

CC(C)CCCCCOC(=O)/C=C/C1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C

InChI

InChI=1S/C25H40O3/c1-18(2)12-10-9-11-15-28-22(26)14-13-19-16-20(24(3,4)5)23(27)21(17-19)25(6,7)8/h13-14,16-18,27H,9-12,15H2,1-8H3/b14-13+