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

Systemtic Name: 1-[2-(cyclopentylamino)-2-oxidanylidene-ethyl]-6-cyclopropyl-3-methyl-pyrazolo[3,4-b]pyridine-4-carboxylate Openeye Name: 1-[2-(cyclopentylamino)-2-oxo-ethyl]-6-cyclopropyl-3-methyl-pyrazolo[3,4-b]pyridine-4-carboxylate CAS Name: 1-[2-(cyclopentylamino)-2-oxoethyl]-6-cyclopropyl-3-methyl-4-pyrazolo[3,4-b]pyridinecarboxylate IUPAC Name: 1-[2-(cyclopentylamino)-2-oxoethyl]-6-cyclopropyl-3-methylpyrazolo[3,4-b]pyridine-4-carboxylate Traditional Name: 1-[2-(cyclopentylamino)-2-keto-ethyl]-6-cyclopropyl-3-methyl-pyrazolo[3,4-b]pyridine-4-carboxylate Formula: C18H21N4O3- MolecularWeight: 341.38434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=CC(=N2)C3CC3)C(=O)[O-])CC(=O)NC4CCCC4

Isomeric SMILES

CC1=NN(C2=C1C(=CC(=N2)C3CC3)C(=O)[O-])CC(=O)NC4CCCC4

InChI

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