1-[2-(cyclopentylamino)-2-oxidanylidene-ethyl]-3-cyclopropyl-6-methyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid

Systemtic Name: 1-[2-(cyclopentylamino)-2-oxidanylidene-ethyl]-3-cyclopropyl-6-methyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid Openeye Name: 1-[2-(cyclopentylamino)-2-oxo-ethyl]-3-cyclopropyl-6-methyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid CAS Name: 1-[2-(cyclopentylamino)-2-oxoethyl]-3-cyclopropyl-6-methyl-4-pyrazolo[3,4-b]pyridinecarboxylic acid IUPAC Name: 1-[2-(cyclopentylamino)-2-oxoethyl]-3-cyclopropyl-6-methylpyrazolo[3,4-b]pyridine-4-carboxylic acid Traditional Name: 1-[2-(cyclopentylamino)-2-keto-ethyl]-3-cyclopropyl-6-methyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid Formula: C18H22N4O3 MolecularWeight: 342.39228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=C1)C(=O)O)C(=NN2CC(=O)NC3CCCC3)C4CC4

Isomeric SMILES

CC1=NC2=C(C(=C1)C(=O)O)C(=NN2CC(=O)NC3CCCC3)C4CC4

InChI

InChI=1S/C18H22N4O3/c1-10-8-13(18(24)25)15-16(11-6-7-11)21-22(17(15)19-10)9-14(23)20-12-4-2-3-5-12/h8,11-12H,2-7,9H2,1H3,(H,20,23)(H,24,25)