(2-octan-4-ylphenyl) 4-[4-(1-pentoxyethyl)phenyl]benzoate

Systemtic Name: (2-octan-4-ylphenyl) 4-[4-(1-pentoxyethyl)phenyl]benzoate Openeye Name: [2-(1-propylpentyl)phenyl] 4-[4-(1-pentoxyethyl)phenyl]benzoate CAS Name: 4-[4-(1-pentoxyethyl)phenyl]benzoic acid (2-octan-4-ylphenyl) ester IUPAC Name: (2-octan-4-ylphenyl) 4-[4-(1-pentoxyethyl)phenyl]benzoate Traditional Name: 4-[4-(1-amoxyethyl)phenyl]benzoic acid [2-(1-propylpentyl)phenyl] ester Formula: C34H44O3 MolecularWeight: 500.71136

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(C)C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=CC=C3C(CCC)CCCC

Isomeric SMILES

CCCCCOC(C)C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=CC=C3C(CCC)CCCC

InChI

InChI=1S/C34H44O3/c1-5-8-12-25-36-26(4)27-17-19-28(20-18-27)29-21-23-31(24-22-29)34(35)37-33-16-11-10-15-32(33)30(13-7-3)14-9-6-2/h10-11,15-24,26,30H,5-9,12-14,25H2,1-4H3