hexan-2-yl 4-[[4-(4-octoxyphenyl)phenyl]methoxy]benzoate

Systemtic Name: hexan-2-yl 4-[[4-(4-octoxyphenyl)phenyl]methoxy]benzoate Openeye Name: 1-methylpentyl 4-[[4-(4-octoxyphenyl)phenyl]methoxy]benzoate CAS Name: 4-[[4-(4-octoxyphenyl)phenyl]methoxy]benzoic acid hexan-2-yl ester IUPAC Name: hexan-2-yl 4-[[4-(4-octoxyphenyl)phenyl]methoxy]benzoate Traditional Name: 4-[4-(4-octoxyphenyl)benzyl]oxybenzoic acid 1-methylpentyl ester Formula: C34H44O4 MolecularWeight: 516.71076

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)COC3=CC=C(C=C3)C(=O)OC(C)CCCC

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)COC3=CC=C(C=C3)C(=O)OC(C)CCCC

InChI

InChI=1S/C34H44O4/c1-4-6-8-9-10-11-25-36-32-21-17-30(18-22-32)29-15-13-28(14-16-29)26-37-33-23-19-31(20-24-33)34(35)38-27(3)12-7-5-2/h13-24,27H,4-12,25-26H2,1-3H3