2-ethylhexyl (E)-3-[4-(3-methylbutoxy)phenyl]prop-2-enoate

Systemtic Name: 2-ethylhexyl (E)-3-[4-(3-methylbutoxy)phenyl]prop-2-enoate Openeye Name: 2-ethylhexyl (E)-3-(4-isopentyloxyphenyl)prop-2-enoate CAS Name: (E)-3-[4-(3-methylbutoxy)phenyl]-2-propenoic acid 2-ethylhexyl ester IUPAC Name: 2-ethylhexyl (E)-3-[4-(3-methylbutoxy)phenyl]prop-2-enoate Traditional Name: (E)-3-(4-isoamoxyphenyl)acrylic acid 2-ethylhexyl ester Formula: C22H34O3 MolecularWeight: 346.50356

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC(=O)C=CC1=CC=C(C=C1)OCCC(C)C

Isomeric SMILES

CCCCC(CC)COC(=O)/C=C/C1=CC=C(C=C1)OCCC(C)C

InChI

InChI=1S/C22H34O3/c1-5-7-8-19(6-2)17-25-22(23)14-11-20-9-12-21(13-10-20)24-16-15-18(3)4/h9-14,18-19H,5-8,15-17H2,1-4H3/b14-11+