(E)-4,4-diethoxy-3-(4-octylphenoxy)but-2-enoate

Systemtic Name: (E)-4,4-diethoxy-3-(4-octylphenoxy)but-2-enoate Openeye Name: (E)-4,4-diethoxy-3-(4-octylphenoxy)but-2-enoate CAS Name: (E)-4,4-diethoxy-3-(4-octylphenoxy)-2-butenoate IUPAC Name: (E)-4,4-diethoxy-3-(4-octylphenoxy)but-2-enoate Traditional Name: (E)-4,4-diethoxy-3-(4-octylphenoxy)but-2-enoate Formula: C22H33O5- MolecularWeight: 377.49442

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)OC(=CC(=O)[O-])C(OCC)OCC

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)O/C(=C/C(=O)[O-])/C(OCC)OCC

InChI

InChI=1S/C22H34O5/c1-4-7-8-9-10-11-12-18-13-15-19(16-14-18)27-20(17-21(23)24)22(25-5-2)26-6-3/h13-17,22H,4-12H2,1-3H3,(H,23,24)/p-1/b20-17+