methyl 3-(2,4,6-trimethylphenyl)prop-2-ynoate

Systemtic Name: methyl 3-(2,4,6-trimethylphenyl)prop-2-ynoate Openeye Name: methyl 3-(2,4,6-trimethylphenyl)prop-2-ynoate CAS Name: 3-(2,4,6-trimethylphenyl)-2-propynoic acid methyl ester IUPAC Name: methyl 3-(2,4,6-trimethylphenyl)prop-2-ynoate Traditional Name: 3-mesitylpropiolic acid methyl ester Formula: C13H14O2 MolecularWeight: 202.24906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C#CC(=O)OC)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C#CC(=O)OC)C

InChI

InChI=1S/C13H14O2/c1-9-7-10(2)12(11(3)8-9)5-6-13(14)15-4/h7-8H,1-4H3