(3-phenethyloxycarbonylphenyl) 3-butoxybenzoate

Systemtic Name: (3-phenethyloxycarbonylphenyl) 3-butoxybenzoate Openeye Name: (3-phenethyloxycarbonylphenyl) 3-butoxybenzoate CAS Name: 3-butoxybenzoic acid [3-[oxo(phenethyloxy)methyl]phenyl] ester IUPAC Name: (3-phenethyloxycarbonylphenyl) 3-butoxybenzoate Traditional Name: 3-butoxybenzoic acid (3-phenethyloxycarbonylphenyl) ester Formula: C26H26O5 MolecularWeight: 418.48164

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)OC2=CC=CC(=C2)C(=O)OCCC3=CC=CC=C3

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)OC2=CC=CC(=C2)C(=O)OCCC3=CC=CC=C3

InChI

InChI=1S/C26H26O5/c1-2-3-16-29-23-13-7-12-22(18-23)26(28)31-24-14-8-11-21(19-24)25(27)30-17-15-20-9-5-4-6-10-20/h4-14,18-19H,2-3,15-17H2,1H3