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

Systemtic Name: (4-octan-2-yloxyphenyl) 2-(4-decanoyloxyphenyl)benzoate Openeye Name: [4-(1-methylheptoxy)phenyl] 2-(4-decanoyloxyphenyl)benzoate CAS Name: 2-[4-(1-oxodecoxy)phenyl]benzoic acid (4-octan-2-yloxyphenyl) ester IUPAC Name: (4-octan-2-yloxyphenyl) 2-(4-decanoyloxyphenyl)benzoate Traditional Name: 2-(4-capryloxyphenyl)benzoic acid [4-(1-methylheptoxy)phenyl] ester Formula: C37H48O5 MolecularWeight: 572.77402

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)OC1=CC=C(C=C1)C2=CC=CC=C2C(=O)OC3=CC=C(C=C3)OC(C)CCCCCC

Isomeric SMILES

CCCCCCCCCC(=O)OC1=CC=C(C=C1)C2=CC=CC=C2C(=O)OC3=CC=C(C=C3)OC(C)CCCCCC

InChI

InChI=1S/C37H48O5/c1-4-6-8-10-11-12-14-20-36(38)41-32-23-21-30(22-24-32)34-18-15-16-19-35(34)37(39)42-33-27-25-31(26-28-33)40-29(3)17-13-9-7-5-2/h15-16,18-19,21-29H,4-14,17,20H2,1-3H3