1-propoxypropan-2-yl 4-(4-hexoxyphenyl)benzoate

Systemtic Name: 1-propoxypropan-2-yl 4-(4-hexoxyphenyl)benzoate Openeye Name: (1-methyl-2-propoxy-ethyl) 4-(4-hexoxyphenyl)benzoate CAS Name: 4-(4-hexoxyphenyl)benzoic acid 1-propoxypropan-2-yl ester IUPAC Name: 1-propoxypropan-2-yl 4-(4-hexoxyphenyl)benzoate Traditional Name: 4-(4-hexoxyphenyl)benzoic acid (1-methyl-2-propoxy-ethyl) ester Formula: C25H34O4 MolecularWeight: 398.53506

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC(C)COCCC

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC(C)COCCC

InChI

InChI=1S/C25H34O4/c1-4-6-7-8-18-28-24-15-13-22(14-16-24)21-9-11-23(12-10-21)25(26)29-20(3)19-27-17-5-2/h9-16,20H,4-8,17-19H2,1-3H3