1-propoxypropyl 3-(4-heptylphenyl)-2-phenyl-benzoate

Systemtic Name: 1-propoxypropyl 3-(4-heptylphenyl)-2-phenyl-benzoate Openeye Name: 1-propoxypropyl 3-(4-heptylphenyl)-2-phenyl-benzoate CAS Name: 3-(4-heptylphenyl)-2-phenylbenzoic acid 1-propoxypropyl ester IUPAC Name: 1-propoxypropyl 3-(4-heptylphenyl)-2-phenylbenzoate Traditional Name: 3-(4-heptylphenyl)-2-phenyl-benzoic acid 1-propoxypropyl ester Formula: C32H40O3 MolecularWeight: 472.6582

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C2=C(C(=CC=C2)C(=O)OC(CC)OCCC)C3=CC=CC=C3

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C2=C(C(=CC=C2)C(=O)OC(CC)OCCC)C3=CC=CC=C3

InChI

InChI=1S/C32H40O3/c1-4-7-8-9-11-15-25-20-22-26(23-21-25)28-18-14-19-29(31(28)27-16-12-10-13-17-27)32(33)35-30(6-3)34-24-5-2/h10,12-14,16-23,30H,4-9,11,15,24H2,1-3H3