(2-octan-4-yloxyphenyl) 4-[4-(1-butoxyethyl)phenyl]benzoate

Systemtic Name: (2-octan-4-yloxyphenyl) 4-[4-(1-butoxyethyl)phenyl]benzoate Openeye Name: [2-(1-propylpentoxy)phenyl] 4-[4-(1-butoxyethyl)phenyl]benzoate CAS Name: 4-[4-(1-butoxyethyl)phenyl]benzoic acid (2-octan-4-yloxyphenyl) ester IUPAC Name: (2-octan-4-yloxyphenyl) 4-[4-(1-butoxyethyl)phenyl]benzoate Traditional Name: 4-[4-(1-butoxyethyl)phenyl]benzoic acid [2-(1-propylpentoxy)phenyl] ester Formula: C33H42O4 MolecularWeight: 502.68418

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCC)OC1=CC=CC=C1OC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)C(C)OCCCC

Isomeric SMILES

CCCCC(CCC)OC1=CC=CC=C1OC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)C(C)OCCCC

InChI

InChI=1S/C33H42O4/c1-5-8-13-30(12-7-3)36-31-14-10-11-15-32(31)37-33(34)29-22-20-28(21-23-29)27-18-16-26(17-19-27)25(4)35-24-9-6-2/h10-11,14-23,25,30H,5-9,12-13,24H2,1-4H3