methyl 4-(2-methoxy-5-methyl-phenyl)but-2-ynoate

Systemtic Name: methyl 4-(2-methoxy-5-methyl-phenyl)but-2-ynoate Openeye Name: methyl 4-(2-methoxy-5-methyl-phenyl)but-2-ynoate CAS Name: 4-(2-methoxy-5-methylphenyl)-2-butynoic acid methyl ester IUPAC Name: methyl 4-(2-methoxy-5-methylphenyl)but-2-ynoate Traditional Name: 4-(2-methoxy-5-methyl-phenyl)but-2-ynoic acid methyl ester Formula: C13H14O3 MolecularWeight: 218.24846

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14O3/c1-10-7-8-12(15-2)11(9-10)5-4-6-13(14)16-3/h7-9H,5H2,1-3H3