methyl 3-[(3-ethynylphenyl)amino]butanoate

Systemtic Name: methyl 3-[(3-ethynylphenyl)amino]butanoate Openeye Name: methyl 3-(3-ethynylanilino)butanoate CAS Name: 3-(3-ethynylanilino)butanoic acid methyl ester IUPAC Name: methyl 3-(3-ethynylanilino)butanoate Traditional Name: 3-(3-ethynylanilino)butyric acid methyl ester Formula: C13H15NO2 MolecularWeight: 217.2637

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)OC)NC1=CC=CC(=C1)C#C

Isomeric SMILES

CC(CC(=O)OC)NC1=CC=CC(=C1)C#C

InChI

InChI=1S/C13H15NO2/c1-4-11-6-5-7-12(9-11)14-10(2)8-13(15)16-3/h1,5-7,9-10,14H,8H2,2-3H3