cyclopropylmethyl 1-(2-chloranyl-2-phenyl-ethyl)-4-oxidanylidene-2H-pyrazolo[3,4-b]pyridine-5-carboxylate

Systemtic Name: cyclopropylmethyl 1-(2-chloranyl-2-phenyl-ethyl)-4-oxidanylidene-2H-pyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: cyclopropylmethyl 1-(2-chloro-2-phenyl-ethyl)-4-oxo-2H-pyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 1-(2-chloro-2-phenylethyl)-4-oxo-2H-pyrazolo[3,4-b]pyridine-5-carboxylic acid cyclopropylmethyl ester IUPAC Name: cyclopropylmethyl 1-(2-chloro-2-phenylethyl)-4-oxo-2H-pyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 1-(2-chloro-2-phenyl-ethyl)-4-keto-2H-pyrazolo[3,4-b]pyridine-5-carboxylic acid cyclopropylmethyl ester Formula: C19H18ClN3O3 MolecularWeight: 371.81752

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1COC(=O)C2=CN=C3C(=CNN3CC(C4=CC=CC=C4)Cl)C2=O

Isomeric SMILES

C1CC1COC(=O)C2=CN=C3C(=CNN3CC(C4=CC=CC=C4)Cl)C2=O

InChI

InChI=1S/C19H18ClN3O3/c20-16(13-4-2-1-3-5-13)10-23-18-14(9-22-23)17(24)15(8-21-18)19(25)26-11-12-6-7-12/h1-5,8-9,12,16,22H,6-7,10-11H2