[4-(4-nonylphenyl)phenyl] 4-(1-nonoxyethyl)benzoate

Systemtic Name: [4-(4-nonylphenyl)phenyl] 4-(1-nonoxyethyl)benzoate Openeye Name: [4-(4-nonylphenyl)phenyl] 4-(1-nonoxyethyl)benzoate CAS Name: 4-(1-nonoxyethyl)benzoic acid [4-(4-nonylphenyl)phenyl] ester IUPAC Name: [4-(4-nonylphenyl)phenyl] 4-(1-nonoxyethyl)benzoate Traditional Name: 4-(1-nonoxyethyl)benzoic acid [4-(4-nonylphenyl)phenyl] ester Formula: C39H54O3 MolecularWeight: 570.84426

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)C(C)OCCCCCCCCC

Isomeric SMILES

CCCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)C(C)OCCCCCCCCC

InChI

InChI=1S/C39H54O3/c1-4-6-8-10-12-14-16-18-33-19-21-35(22-20-33)36-27-29-38(30-28-36)42-39(40)37-25-23-34(24-26-37)32(3)41-31-17-15-13-11-9-7-5-2/h19-30,32H,4-18,31H2,1-3H3