(2-dodecan-4-yloxyphenyl) 4-[4-(1-propoxyethyl)phenyl]benzoate

Systemtic Name: (2-dodecan-4-yloxyphenyl) 4-[4-(1-propoxyethyl)phenyl]benzoate Openeye Name: [2-(1-propylnonoxy)phenyl] 4-[4-(1-propoxyethyl)phenyl]benzoate CAS Name: 4-[4-(1-propoxyethyl)phenyl]benzoic acid (2-dodecan-4-yloxyphenyl) ester IUPAC Name: (2-dodecan-4-yloxyphenyl) 4-[4-(1-propoxyethyl)phenyl]benzoate Traditional Name: 4-[4-(1-propoxyethyl)phenyl]benzoic acid [2-(1-propylnonoxy)phenyl] ester Formula: C36H48O4 MolecularWeight: 544.76392

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(CCC)OC1=CC=CC=C1OC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)C(C)OCCC

Isomeric SMILES

CCCCCCCCC(CCC)OC1=CC=CC=C1OC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)C(C)OCCC

InChI

InChI=1S/C36H48O4/c1-5-8-9-10-11-12-16-33(15-6-2)39-34-17-13-14-18-35(34)40-36(37)32-25-23-31(24-26-32)30-21-19-29(20-22-30)28(4)38-27-7-3/h13-14,17-26,28,33H,5-12,15-16,27H2,1-4H3