[2-[2-(4-butylphenyl)ethynyl]-6-methoxy-4-methyl-phenyl] ethanoate

Systemtic Name: [2-[2-(4-butylphenyl)ethynyl]-6-methoxy-4-methyl-phenyl] ethanoate Openeye Name: [2-[2-(4-butylphenyl)ethynyl]-6-methoxy-4-methyl-phenyl] acetate CAS Name: acetic acid [2-[2-(4-butylphenyl)ethynyl]-6-methoxy-4-methylphenyl] ester IUPAC Name: [2-[2-(4-butylphenyl)ethynyl]-6-methoxy-4-methylphenyl] acetate Traditional Name: acetic acid [2-[2-(4-butylphenyl)ethynyl]-6-methoxy-4-methyl-phenyl] ester Formula: C22H24O3 MolecularWeight: 336.42416

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C#CC2=CC(=CC(=C2OC(=O)C)OC)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)C#CC2=CC(=CC(=C2OC(=O)C)OC)C

InChI

InChI=1S/C22H24O3/c1-5-6-7-18-8-10-19(11-9-18)12-13-20-14-16(2)15-21(24-4)22(20)25-17(3)23/h8-11,14-15H,5-7H2,1-4H3