2-[[3-(aminomethyl)-2-cyano-phenyl]amino]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[[3-(aminomethyl)-2-cyano-phenyl]amino]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[3-(aminomethyl)-2-cyano-anilino]-2-oxo-acetic acid CAS Name: 2-[3-(aminomethyl)-2-cyanoanilino]-2-oxoacetic acid IUPAC Name: 2-[3-(aminomethyl)-2-cyanoanilino]-2-oxoacetic acid Traditional Name: 2-[3-(aminomethyl)-2-cyano-anilino]-2-keto-acetic acid Formula: C10H9N3O3 MolecularWeight: 219.19676

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)NC(=O)C(=O)O)C#N)CN

Isomeric SMILES

C1=CC(=C(C(=C1)NC(=O)C(=O)O)C#N)CN

InChI

InChI=1S/C10H9N3O3/c11-4-6-2-1-3-8(7(6)5-12)13-9(14)10(15)16/h1-3H,4,11H2,(H,13,14)(H,15,16)