methyl 3-[(3-ethynylphenyl)amino]-2-methyl-propanoate

Systemtic Name: methyl 3-[(3-ethynylphenyl)amino]-2-methyl-propanoate Openeye Name: methyl 3-(3-ethynylanilino)-2-methyl-propanoate CAS Name: 3-(3-ethynylanilino)-2-methylpropanoic acid methyl ester IUPAC Name: methyl 3-(3-ethynylanilino)-2-methylpropanoate Traditional Name: 3-(3-ethynylanilino)-2-methyl-propionic acid methyl ester Formula: C13H15NO2 MolecularWeight: 217.2637

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC1=CC=CC(=C1)C#C)C(=O)OC

Isomeric SMILES

CC(CNC1=CC=CC(=C1)C#C)C(=O)OC

InChI

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