(4-heptoxyphenyl) 4-(4-methylhexoxy)benzoate

Systemtic Name: (4-heptoxyphenyl) 4-(4-methylhexoxy)benzoate Openeye Name: (4-heptoxyphenyl) 4-(4-methylhexoxy)benzoate CAS Name: 4-(4-methylhexoxy)benzoic acid (4-heptoxyphenyl) ester IUPAC Name: (4-heptoxyphenyl) 4-(4-methylhexoxy)benzoate Traditional Name: 4-(4-methylhexoxy)benzoic acid (4-heptoxyphenyl) ester Formula: C27H38O4 MolecularWeight: 426.58822

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)OCCCC(C)CC

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)OCCCC(C)CC

InChI

InChI=1S/C27H38O4/c1-4-6-7-8-9-20-29-25-16-18-26(19-17-25)31-27(28)23-12-14-24(15-13-23)30-21-10-11-22(3)5-2/h12-19,22H,4-11,20-21H2,1-3H3