3-oxidanylidene-3-[phenyl(prop-2-ynyl)amino]propanoic acid

Systemtic Name: 3-oxidanylidene-3-[phenyl(prop-2-ynyl)amino]propanoic acid Openeye Name: 3-oxo-3-(N-prop-2-ynylanilino)propanoic acid CAS Name: 3-oxo-3-(N-prop-2-ynylanilino)propanoic acid IUPAC Name: 3-oxo-3-(N-prop-2-ynylanilino)propanoic acid Traditional Name: 3-keto-3-(N-propargylanilino)propionic acid Formula: C12H11NO3 MolecularWeight: 217.22064

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN(C1=CC=CC=C1)C(=O)CC(=O)O

Isomeric SMILES

C#CCN(C1=CC=CC=C1)C(=O)CC(=O)O

InChI

InChI=1S/C12H11NO3/c1-2-8-13(11(14)9-12(15)16)10-6-4-3-5-7-10/h1,3-7H,8-9H2,(H,15,16)