3-methylbutyl (Z)-2-methoxy-3-(4-octylphenyl)prop-2-enoate

Systemtic Name: 3-methylbutyl (Z)-2-methoxy-3-(4-octylphenyl)prop-2-enoate Openeye Name: isopentyl (Z)-2-methoxy-3-(4-octylphenyl)prop-2-enoate CAS Name: (Z)-2-methoxy-3-(4-octylphenyl)-2-propenoic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl (Z)-2-methoxy-3-(4-octylphenyl)prop-2-enoate Traditional Name: (Z)-2-methoxy-3-(4-octylphenyl)acrylic acid isoamyl ester Formula: C23H36O3 MolecularWeight: 360.53014

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C=C(C(=O)OCCC(C)C)OC

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)/C=C(/C(=O)OCCC(C)C)\OC

InChI

InChI=1S/C23H36O3/c1-5-6-7-8-9-10-11-20-12-14-21(15-13-20)18-22(25-4)23(24)26-17-16-19(2)3/h12-15,18-19H,5-11,16-17H2,1-4H3/b22-18-