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4-(4-methoxyphenyl)butyl 2-(2-phenylethynyl)benzoate

4-(4-methoxyphenyl)butyl 2-(2-phenylethynyl)benzoate

Systemtic Name:4-(4-methoxyphenyl)butyl 2-(2-phenylethynyl)benzoate
Openeye Name:4-(4-methoxyphenyl)butyl 2-(2-phenylethynyl)benzoate
CAS Name:2-(2-phenylethynyl)benzoic acid 4-(4-methoxyphenyl)butyl ester
IUPAC Name:4-(4-methoxyphenyl)butyl 2-(2-phenylethynyl)benzoate
Traditional Name:2-(2-phenylethynyl)benzoic acid 4-(4-methoxyphenyl)butyl ester
Formula: C26H24O3
MolecularWeight: 384.46696
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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCCCOC(=O)C2=CC=CC=C2C#CC3=CC=CC=C3


Isomeric SMILES

COC1=CC=C(C=C1)CCCCOC(=O)C2=CC=CC=C2C#CC3=CC=CC=C3


InChI

InChI=1S/C26H24O3/c1-28-24-18-15-22(16-19-24)11-7-8-20-29-26(27)25-13-6-5-12-23(25)17-14-21-9-3-2-4-10-21/h2-6,9-10,12-13,15-16,18-19H,7-8,11,20H2,1H3


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