(4-octoxyphenyl) 4-(4-octan-2-yloxyphenyl)benzoate

Systemtic Name: (4-octoxyphenyl) 4-(4-octan-2-yloxyphenyl)benzoate Openeye Name: (4-octoxyphenyl) 4-[4-(1-methylheptoxy)phenyl]benzoate CAS Name: 4-(4-octan-2-yloxyphenyl)benzoic acid (4-octoxyphenyl) ester IUPAC Name: (4-octoxyphenyl) 4-(4-octan-2-yloxyphenyl)benzoate Traditional Name: 4-[4-(1-methylheptoxy)phenyl]benzoic acid (4-octoxyphenyl) ester Formula: C35H46O4 MolecularWeight: 530.73734

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)OC(C)CCCCCC

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)OC(C)CCCCCC

InChI

InChI=1S/C35H46O4/c1-4-6-8-10-11-13-27-37-32-23-25-34(26-24-32)39-35(36)31-17-15-29(16-18-31)30-19-21-33(22-20-30)38-28(3)14-12-9-7-5-2/h15-26,28H,4-14,27H2,1-3H3