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(4-propylphenyl) 4-[2-(4-propylphenyl)ethynyl]benzoate

(4-propylphenyl) 4-[2-(4-propylphenyl)ethynyl]benzoate

Systemtic Name:(4-propylphenyl) 4-[2-(4-propylphenyl)ethynyl]benzoate
Openeye Name:(4-propylphenyl) 4-[2-(4-propylphenyl)ethynyl]benzoate
CAS Name:4-[2-(4-propylphenyl)ethynyl]benzoic acid (4-propylphenyl) ester
IUPAC Name:(4-propylphenyl) 4-[2-(4-propylphenyl)ethynyl]benzoate
Traditional Name:4-[2-(4-propylphenyl)ethynyl]benzoic acid (4-propylphenyl) ester
Formula: C27H26O2
MolecularWeight: 382.49414
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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C#CC2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)CCC


Isomeric SMILES

CCCC1=CC=C(C=C1)C#CC2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)CCC


InChI

InChI=1S/C27H26O2/c1-3-5-21-7-9-23(10-8-21)11-12-24-13-17-25(18-14-24)27(28)29-26-19-15-22(6-4-2)16-20-26/h7-10,13-20H,3-6H2,1-2H3


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