2-azanyl-2-[4-(1H-pyrazolo[3,4-b]pyridin-4-ylcarbamoyl)phenyl]ethanoic acid

Systemtic Name: 2-azanyl-2-[4-(1H-pyrazolo[3,4-b]pyridin-4-ylcarbamoyl)phenyl]ethanoic acid Openeye Name: 2-amino-2-[4-(1H-pyrazolo[3,4-b]pyridin-4-ylcarbamoyl)phenyl]acetic acid CAS Name: 2-amino-2-[4-[oxo-(1H-pyrazolo[3,4-b]pyridin-4-ylamino)methyl]phenyl]acetic acid IUPAC Name: 2-amino-2-[4-(1H-pyrazolo[3,4-b]pyridin-4-ylcarbamoyl)phenyl]acetic acid Traditional Name: 2-amino-2-[4-(1H-pyrazolo[3,4-b]pyridin-4-ylcarbamoyl)phenyl]acetic acid Formula: C15H13N5O3 MolecularWeight: 311.29542

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(C(=O)O)N)C(=O)NC2=C3C=NNC3=NC=C2

Isomeric SMILES

C1=CC(=CC=C1C(C(=O)O)N)C(=O)NC2=C3C=NNC3=NC=C2

InChI

InChI=1S/C15H13N5O3/c16-12(15(22)23)8-1-3-9(4-2-8)14(21)19-11-5-6-17-13-10(11)7-18-20-13/h1-7,12H,16H2,(H,22,23)(H2,17,18,19,20,21)