methyl 4-(4-octadecoxyphenyl)benzoate

Systemtic Name: methyl 4-(4-octadecoxyphenyl)benzoate Openeye Name: methyl 4-(4-octadecoxyphenyl)benzoate CAS Name: 4-(4-octadecoxyphenyl)benzoic acid methyl ester IUPAC Name: methyl 4-(4-octadecoxyphenyl)benzoate Traditional Name: 4-(4-stearyloxyphenyl)benzoic acid methyl ester Formula: C32H48O3 MolecularWeight: 480.72172

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C32H48O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-27-35-31-25-23-29(24-26-31)28-19-21-30(22-20-28)32(33)34-2/h19-26H,3-18,27H2,1-2H3