3-phenylpropyl 3-(4-propoxyphenyl)carbonyloxybenzoate

Systemtic Name: 3-phenylpropyl 3-(4-propoxyphenyl)carbonyloxybenzoate Openeye Name: 3-phenylpropyl 3-(4-propoxybenzoyl)oxybenzoate CAS Name: 3-[oxo-(4-propoxyphenyl)methoxy]benzoic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 3-(4-propoxybenzoyl)oxybenzoate Traditional Name: 3-(4-propoxybenzoyl)oxybenzoic acid 3-phenylpropyl ester Formula: C26H26O5 MolecularWeight: 418.48164

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)OC2=CC=CC(=C2)C(=O)OCCCC3=CC=CC=C3

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)OC2=CC=CC(=C2)C(=O)OCCCC3=CC=CC=C3

InChI

InChI=1S/C26H26O5/c1-2-17-29-23-15-13-21(14-16-23)26(28)31-24-12-6-11-22(19-24)25(27)30-18-7-10-20-8-4-3-5-9-20/h3-6,8-9,11-16,19H,2,7,10,17-18H2,1H3