4-octoxypentyl 4-(4-decoxyphenyl)benzoate

Systemtic Name: 4-octoxypentyl 4-(4-decoxyphenyl)benzoate Openeye Name: 4-octoxypentyl 4-(4-decoxyphenyl)benzoate CAS Name: 4-(4-decoxyphenyl)benzoic acid 4-octoxypentyl ester IUPAC Name: 4-octoxypentyl 4-(4-decoxyphenyl)benzoate Traditional Name: 4-(4-decoxyphenyl)benzoic acid 4-octoxypentyl ester Formula: C36H56O4 MolecularWeight: 552.82744

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OCCCC(C)OCCCCCCCC

Isomeric SMILES

CCCCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OCCCC(C)OCCCCCCCC

InChI

InChI=1S/C36H56O4/c1-4-6-8-10-12-13-15-17-29-39-35-26-24-33(25-27-35)32-20-22-34(23-21-32)36(37)40-30-18-19-31(3)38-28-16-14-11-9-7-5-2/h20-27,31H,4-19,28-30H2,1-3H3