1-methoxypropan-2-yl 4-(4-octylphenyl)benzoate

Systemtic Name: 1-methoxypropan-2-yl 4-(4-octylphenyl)benzoate Openeye Name: (2-methoxy-1-methyl-ethyl) 4-(4-octylphenyl)benzoate CAS Name: 4-(4-octylphenyl)benzoic acid 1-methoxypropan-2-yl ester IUPAC Name: 1-methoxypropan-2-yl 4-(4-octylphenyl)benzoate Traditional Name: 4-(4-octylphenyl)benzoic acid (2-methoxy-1-methyl-ethyl) ester Formula: C25H34O3 MolecularWeight: 382.53566

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC(C)COC

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC(C)COC

InChI

InChI=1S/C25H34O3/c1-4-5-6-7-8-9-10-21-11-13-22(14-12-21)23-15-17-24(18-16-23)25(26)28-20(2)19-27-3/h11-18,20H,4-10,19H2,1-3H3