4-(3-methyl-6-oxidanylidene-1-pyrimidin-2-yl-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-4-yl)benzoic acid

Systemtic Name: 4-(3-methyl-6-oxidanylidene-1-pyrimidin-2-yl-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-4-yl)benzoic acid Openeye Name: 4-(3-methyl-6-oxo-1-pyrimidin-2-yl-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-4-yl)benzoic acid CAS Name: 4-[3-methyl-6-oxo-1-(2-pyrimidinyl)-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-4-yl]benzoic acid IUPAC Name: 4-(3-methyl-6-oxo-1-pyrimidin-2-yl-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-4-yl)benzoic acid Traditional Name: 4-[6-keto-3-methyl-1-(2-pyrimidyl)-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-4-yl]benzoic acid Formula: C18H15N5O3 MolecularWeight: 349.3434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(CC(=O)N=C2N(N1)C3=NC=CC=N3)C4=CC=C(C=C4)C(=O)O

Isomeric SMILES

CC1=C2C(CC(=O)N=C2N(N1)C3=NC=CC=N3)C4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C18H15N5O3/c1-10-15-13(11-3-5-12(6-4-11)17(25)26)9-14(24)21-16(15)23(22-10)18-19-7-2-8-20-18/h2-8,13,22H,9H2,1H3,(H,25,26)