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

Systemtic Name: [4-[(E)-3-oxidanylidene-3-phenyl-prop-1-enyl]phenyl] 13-[(4-ethenylphenyl)methoxy]tridecanoate Openeye Name: [4-[(E)-3-oxo-3-phenyl-prop-1-enyl]phenyl] 13-[(4-vinylphenyl)methoxy]tridecanoate CAS Name: 13-[(4-ethenylphenyl)methoxy]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)methoxy]tridecanoate Traditional Name: 13-(4-vinylbenzyl)oxytridecanoic acid [4-[(E)-3-keto-3-phenyl-prop-1-enyl]phenyl] ester Formula: C37H44O4 MolecularWeight: 552.74286

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C37H44O4/c1-2-31-19-21-33(22-20-31)30-40-29-15-10-8-6-4-3-5-7-9-14-18-37(39)41-35-26-23-32(24-27-35)25-28-36(38)34-16-12-11-13-17-34/h2,11-13,16-17,19-28H,1,3-10,14-15,18,29-30H2/b28-25+