(2-pentadecoxyphenyl) 4-(1-octoxyethyl)benzoate

Systemtic Name: (2-pentadecoxyphenyl) 4-(1-octoxyethyl)benzoate Openeye Name: (2-pentadecoxyphenyl) 4-(1-octoxyethyl)benzoate CAS Name: 4-(1-octoxyethyl)benzoic acid (2-pentadecoxyphenyl) ester IUPAC Name: (2-pentadecoxyphenyl) 4-(1-octoxyethyl)benzoate Traditional Name: 4-(1-octoxyethyl)benzoic acid (2-pentadecoxyphenyl) ester Formula: C38H60O4 MolecularWeight: 580.8806

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCOC1=CC=CC=C1OC(=O)C2=CC=C(C=C2)C(C)OCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCOC1=CC=CC=C1OC(=O)C2=CC=C(C=C2)C(C)OCCCCCCCC

InChI

InChI=1S/C38H60O4/c1-4-6-8-10-12-13-14-15-16-17-18-20-24-32-41-36-25-21-22-26-37(36)42-38(39)35-29-27-34(28-30-35)33(3)40-31-23-19-11-9-7-5-2/h21-22,25-30,33H,4-20,23-24,31-32H2,1-3H3