[4-[(E)-3-oxidanylidene-3-phenyl-prop-1-enyl]phenyl] 13-(4-ethenylphenyl)tridecanoate

Systemtic Name: [4-[(E)-3-oxidanylidene-3-phenyl-prop-1-enyl]phenyl] 13-(4-ethenylphenyl)tridecanoate Openeye Name: [4-[(E)-3-oxo-3-phenyl-prop-1-enyl]phenyl] 13-(4-vinylphenyl)tridecanoate CAS Name: 13-(4-ethenylphenyl)tridecanoic acid [4-[(E)-3-oxo-3-phenylprop-1-enyl]phenyl] ester IUPAC Name: [4-[(E)-3-oxo-3-phenylprop-1-enyl]phenyl] 13-(4-ethenylphenyl)tridecanoate Traditional Name: 13-(4-vinylphenyl)tridecanoic acid [4-[(E)-3-keto-3-phenyl-prop-1-enyl]phenyl] ester Formula: C36H42O3 MolecularWeight: 522.71688

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Descriptors Computed from Structure

Canonical SMILES:

C=CC1=CC=C(C=C1)CCCCCCCCCCCCC(=O)OC2=CC=C(C=C2)C=CC(=O)C3=CC=CC=C3

Isomeric SMILES

C=CC1=CC=C(C=C1)CCCCCCCCCCCCC(=O)OC2=CC=C(C=C2)/C=C/C(=O)C3=CC=CC=C3

InChI

InChI=1S/C36H42O3/c1-2-30-20-22-31(23-21-30)16-12-9-7-5-3-4-6-8-10-15-19-36(38)39-34-27-24-32(25-28-34)26-29-35(37)33-17-13-11-14-18-33/h2,11,13-14,17-18,20-29H,1,3-10,12,15-16,19H2/b29-26+