methyl 4-(4-dimethylaminophenyl)-4-oxidanylidene-but-2-ynoate

Systemtic Name: methyl 4-(4-dimethylaminophenyl)-4-oxidanylidene-but-2-ynoate Openeye Name: methyl 4-(4-dimethylaminophenyl)-4-oxo-but-2-ynoate CAS Name: 4-(4-dimethylaminophenyl)-4-oxo-2-butynoic acid methyl ester IUPAC Name: methyl 4-(4-dimethylaminophenyl)-4-oxobut-2-ynoate Traditional Name: 4-(4-dimethylaminophenyl)-4-keto-but-2-ynoic acid methyl ester Formula: C13H13NO3 MolecularWeight: 231.24722

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13NO3/c1-14(2)11-6-4-10(5-7-11)12(15)8-9-13(16)17-3/h4-7H,1-3H3