2-[[2-[cyanomethyl(phenyl)amino]-2-oxidanylidene-ethyl]amino]ethanoic acid

Systemtic Name: 2-[[2-[cyanomethyl(phenyl)amino]-2-oxidanylidene-ethyl]amino]ethanoic acid Openeye Name: 2-[[2-[N-(cyanomethyl)anilino]-2-oxo-ethyl]amino]acetic acid CAS Name: 2-[[2-[N-(cyanomethyl)anilino]-2-oxoethyl]amino]acetic acid IUPAC Name: 2-[[2-[N-(cyanomethyl)anilino]-2-oxoethyl]amino]acetic acid Traditional Name: 2-[[2-[N-(cyanomethyl)anilino]-2-keto-ethyl]amino]acetic acid Formula: C12H13N3O3 MolecularWeight: 247.24992

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(CC#N)C(=O)CNCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)N(CC#N)C(=O)CNCC(=O)O

InChI

InChI=1S/C12H13N3O3/c13-6-7-15(10-4-2-1-3-5-10)11(16)8-14-9-12(17)18/h1-5,14H,7-9H2,(H,17,18)