methyl 4-(3-methylphenyl)-4-oxidanylidene-but-2-ynoate

Systemtic Name: methyl 4-(3-methylphenyl)-4-oxidanylidene-but-2-ynoate Openeye Name: methyl 4-(m-tolyl)-4-oxo-but-2-ynoate CAS Name: 4-(3-methylphenyl)-4-oxo-2-butynoic acid methyl ester IUPAC Name: methyl 4-(3-methylphenyl)-4-oxobut-2-ynoate Traditional Name: 4-keto-4-(m-tolyl)but-2-ynoic acid methyl ester Formula: C12H10O3 MolecularWeight: 202.206

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H10O3/c1-9-4-3-5-10(8-9)11(13)6-7-12(14)15-2/h3-5,8H,1-2H3