[4-(4-heptylphenyl)phenyl] 4-(1-heptoxyethyl)benzoate

Systemtic Name: [4-(4-heptylphenyl)phenyl] 4-(1-heptoxyethyl)benzoate Openeye Name: [4-(4-heptylphenyl)phenyl] 4-(1-heptoxyethyl)benzoate CAS Name: 4-(1-heptoxyethyl)benzoic acid [4-(4-heptylphenyl)phenyl] ester IUPAC Name: [4-(4-heptylphenyl)phenyl] 4-(1-heptoxyethyl)benzoate Traditional Name: 4-(1-heptoxyethyl)benzoic acid [4-(4-heptylphenyl)phenyl] ester Formula: C35H46O3 MolecularWeight: 514.73794

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)C(C)OCCCCCCC

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)C(C)OCCCCCCC

InChI

InChI=1S/C35H46O3/c1-4-6-8-10-12-14-29-15-17-31(18-16-29)32-23-25-34(26-24-32)38-35(36)33-21-19-30(20-22-33)28(3)37-27-13-11-9-7-5-2/h15-26,28H,4-14,27H2,1-3H3