2-[[2-cyano-3-[methyl(propan-2-yl)amino]phenyl]amino]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[[2-cyano-3-[methyl(propan-2-yl)amino]phenyl]amino]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[2-cyano-3-[isopropyl(methyl)amino]anilino]-2-oxo-acetic acid CAS Name: 2-[2-cyano-3-[methyl(propan-2-yl)amino]anilino]-2-oxoacetic acid IUPAC Name: 2-[2-cyano-3-[methyl(propan-2-yl)amino]anilino]-2-oxoacetic acid Traditional Name: 2-[2-cyano-3-[isopropyl(methyl)amino]anilino]-2-keto-acetic acid Formula: C13H15N3O3 MolecularWeight: 261.2765

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C)C1=CC=CC(=C1C#N)NC(=O)C(=O)O

Isomeric SMILES

CC(C)N(C)C1=CC=CC(=C1C#N)NC(=O)C(=O)O

InChI

InChI=1S/C13H15N3O3/c1-8(2)16(3)11-6-4-5-10(9(11)7-14)15-12(17)13(18)19/h4-6,8H,1-3H3,(H,15,17)(H,18,19)