methyl 3-(3-methoxy-3-oxidanylidene-prop-1-ynyl)benzoate

Systemtic Name: methyl 3-(3-methoxy-3-oxidanylidene-prop-1-ynyl)benzoate Openeye Name: methyl 3-(3-methoxy-3-oxo-prop-1-ynyl)benzoate CAS Name: 3-(3-methoxy-3-oxoprop-1-ynyl)benzoic acid methyl ester IUPAC Name: methyl 3-(3-methoxy-3-oxoprop-1-ynyl)benzoate Traditional Name: 3-(3-keto-3-methoxy-prop-1-ynyl)benzoic acid methyl ester Formula: C12H10O4 MolecularWeight: 218.2054

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H10O4/c1-15-11(13)7-6-9-4-3-5-10(8-9)12(14)16-2/h3-5,8H,1-2H3