(phenylmethyl) 4-[(E)-3-(4-butoxy-3-ethoxy-phenyl)prop-2-enoyl]oxybenzoate

Systemtic Name: (phenylmethyl) 4-[(E)-3-(4-butoxy-3-ethoxy-phenyl)prop-2-enoyl]oxybenzoate Openeye Name: benzyl 4-[(E)-3-(4-butoxy-3-ethoxy-phenyl)prop-2-enoyl]oxybenzoate CAS Name: 4-[(E)-3-(4-butoxy-3-ethoxyphenyl)-1-oxoprop-2-enoxy]benzoic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[(E)-3-(4-butoxy-3-ethoxyphenyl)prop-2-enoyl]oxybenzoate Traditional Name: 4-[(E)-3-(4-butoxy-3-ethoxy-phenyl)acryloyl]oxybenzoic acid benzyl ester Formula: C29H30O6 MolecularWeight: 474.5449

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C=CC(=O)OC2=CC=C(C=C2)C(=O)OCC3=CC=CC=C3)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)/C=C/C(=O)OC2=CC=C(C=C2)C(=O)OCC3=CC=CC=C3)OCC

InChI

InChI=1S/C29H30O6/c1-3-5-19-33-26-17-11-22(20-27(26)32-4-2)12-18-28(30)35-25-15-13-24(14-16-25)29(31)34-21-23-9-7-6-8-10-23/h6-18,20H,3-5,19,21H2,1-2H3/b18-12+