2-[(1-ethyl-3-methyl-4-oxidanylidene-2H-pyrazolo[3,4-b]pyridin-5-yl)carbonylamino]-2-phenyl-ethanoic acid

Systemtic Name: 2-[(1-ethyl-3-methyl-4-oxidanylidene-2H-pyrazolo[3,4-b]pyridin-5-yl)carbonylamino]-2-phenyl-ethanoic acid Openeye Name: 2-[(1-ethyl-3-methyl-4-oxo-2H-pyrazolo[3,4-b]pyridine-5-carbonyl)amino]-2-phenyl-acetic acid CAS Name: 2-[[(1-ethyl-3-methyl-4-oxo-2H-pyrazolo[3,4-b]pyridin-5-yl)-oxomethyl]amino]-2-phenylacetic acid IUPAC Name: 2-[(1-ethyl-3-methyl-4-oxo-2H-pyrazolo[3,4-b]pyridine-5-carbonyl)amino]-2-phenylacetic acid Traditional Name: 2-[(1-ethyl-4-keto-3-methyl-2H-pyrazolo[3,4-b]pyridine-5-carbonyl)amino]-2-phenyl-acetic acid Formula: C18H18N4O4 MolecularWeight: 354.35992

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=NC=C(C(=O)C2=C(N1)C)C(=O)NC(C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CCN1C2=NC=C(C(=O)C2=C(N1)C)C(=O)NC(C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C18H18N4O4/c1-3-22-16-13(10(2)21-22)15(23)12(9-19-16)17(24)20-14(18(25)26)11-7-5-4-6-8-11/h4-9,14,21H,3H2,1-2H3,(H,20,24)(H,25,26)