1,3-dimethyl-N-[2-[(2-nitrophenyl)amino]ethyl]pyrazolo[3,4-b]pyridine-5-carboxamide

Systemtic Name: 1,3-dimethyl-N-[2-[(2-nitrophenyl)amino]ethyl]pyrazolo[3,4-b]pyridine-5-carboxamide Openeye Name: 1,3-dimethyl-N-[2-(2-nitroanilino)ethyl]pyrazolo[3,4-b]pyridine-5-carboxamide CAS Name: 1,3-dimethyl-N-[2-(2-nitroanilino)ethyl]-5-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: 1,3-dimethyl-N-[2-(2-nitroanilino)ethyl]pyrazolo[3,4-b]pyridine-5-carboxamide Traditional Name: 1,3-dimethyl-N-[2-(2-nitroanilino)ethyl]pyrazolo[3,4-b]pyridine-5-carboxamide Formula: C17H18N6O3 MolecularWeight: 354.36322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=NC=C(C=C12)C(=O)NCCNC3=CC=CC=C3[N+](=O)[O-])C

Isomeric SMILES

CC1=NN(C2=NC=C(C=C12)C(=O)NCCNC3=CC=CC=C3[N+](=O)[O-])C

InChI

InChI=1S/C17H18N6O3/c1-11-13-9-12(10-20-16(13)22(2)21-11)17(24)19-8-7-18-14-5-3-4-6-15(14)23(25)26/h3-6,9-10,18H,7-8H2,1-2H3,(H,19,24)