(14,14-dimethyl-13-oxidanylidene-hexadecyl) (E)-3-(3,4-dimethoxyphenyl)prop-2-enoate

Systemtic Name: (14,14-dimethyl-13-oxidanylidene-hexadecyl) (E)-3-(3,4-dimethoxyphenyl)prop-2-enoate Openeye Name: (14,14-dimethyl-13-oxo-hexadecyl) (E)-3-(3,4-dimethoxyphenyl)prop-2-enoate CAS Name: (E)-3-(3,4-dimethoxyphenyl)-2-propenoic acid (14,14-dimethyl-13-oxohexadecyl) ester IUPAC Name: (14,14-dimethyl-13-oxohexadecyl) (E)-3-(3,4-dimethoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(3,4-dimethoxyphenyl)acrylic acid (13-keto-14,14-dimethyl-hexadecyl) ester Formula: C29H46O5 MolecularWeight: 474.67254

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C(=O)CCCCCCCCCCCCOC(=O)C=CC1=CC(=C(C=C1)OC)OC

Isomeric SMILES

CCC(C)(C)C(=O)CCCCCCCCCCCCOC(=O)/C=C/C1=CC(=C(C=C1)OC)OC

InChI

InChI=1S/C29H46O5/c1-6-29(2,3)27(30)17-15-13-11-9-7-8-10-12-14-16-22-34-28(31)21-19-24-18-20-25(32-4)26(23-24)33-5/h18-21,23H,6-17,22H2,1-5H3/b21-19+