[4-[(E)-3-(2-methylbutoxy)-3-oxidanylidene-prop-1-enyl]phenyl]methyl 2-tetradecan-4-yloxybenzoate

Systemtic Name: [4-[(E)-3-(2-methylbutoxy)-3-oxidanylidene-prop-1-enyl]phenyl]methyl 2-tetradecan-4-yloxybenzoate Openeye Name: [4-[(E)-3-(2-methylbutoxy)-3-oxo-prop-1-enyl]phenyl]methyl 2-(1-propylundecoxy)benzoate CAS Name: 2-tetradecan-4-yloxybenzoic acid [4-[(E)-3-(2-methylbutoxy)-3-oxoprop-1-enyl]phenyl]methyl ester IUPAC Name: [4-[(E)-3-(2-methylbutoxy)-3-oxoprop-1-enyl]phenyl]methyl 2-tetradecan-4-yloxybenzoate Traditional Name: 2-(1-propylundecoxy)benzoic acid [4-[(E)-3-keto-3-(2-methylbutoxy)prop-1-enyl]benzyl] ester Formula: C36H52O5 MolecularWeight: 564.79508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(CCC)OC1=CC=CC=C1C(=O)OCC2=CC=C(C=C2)C=CC(=O)OCC(C)CC

Isomeric SMILES

CCCCCCCCCCC(CCC)OC1=CC=CC=C1C(=O)OCC2=CC=C(C=C2)/C=C/C(=O)OCC(C)CC

InChI

InChI=1S/C36H52O5/c1-5-8-9-10-11-12-13-14-18-32(17-6-2)41-34-20-16-15-19-33(34)36(38)40-28-31-23-21-30(22-24-31)25-26-35(37)39-27-29(4)7-3/h15-16,19-26,29,32H,5-14,17-18,27-28H2,1-4H3/b26-25+