[4-(2-dimethylaminoethylamino)phenyl] 2-pyrazolo[3,4-b]pyridin-1-ylethanoate

Systemtic Name: [4-(2-dimethylaminoethylamino)phenyl] 2-pyrazolo[3,4-b]pyridin-1-ylethanoate Openeye Name: [4-(2-dimethylaminoethylamino)phenyl] 2-pyrazolo[3,4-b]pyridin-1-ylacetate CAS Name: 2-(1-pyrazolo[3,4-b]pyridinyl)acetic acid [4-(2-dimethylaminoethylamino)phenyl] ester IUPAC Name: [4-(2-dimethylaminoethylamino)phenyl] 2-pyrazolo[3,4-b]pyridin-1-ylacetate Traditional Name: 2-pyrazolo[3,4-b]pyridin-1-ylacetic acid [4-(2-dimethylaminoethylamino)phenyl] ester Formula: C18H21N5O2 MolecularWeight: 339.39164

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC1=CC=C(C=C1)OC(=O)CN2C3=C(C=CC=N3)C=N2

Isomeric SMILES

CN(C)CCNC1=CC=C(C=C1)OC(=O)CN2C3=C(C=CC=N3)C=N2

InChI

InChI=1S/C18H21N5O2/c1-22(2)11-10-19-15-5-7-16(8-6-15)25-17(24)13-23-18-14(12-21-23)4-3-9-20-18/h3-9,12,19H,10-11,13H2,1-2H3