N-(2-chloranyl-5-nitro-phenyl)-2-(3-methyl-4-phenyl-pyrazolo[3,4-b]pyridin-1-yl)ethanamide

Systemtic Name: N-(2-chloranyl-5-nitro-phenyl)-2-(3-methyl-4-phenyl-pyrazolo[3,4-b]pyridin-1-yl)ethanamide Openeye Name: N-(2-chloro-5-nitro-phenyl)-2-(3-methyl-4-phenyl-pyrazolo[3,4-b]pyridin-1-yl)acetamide CAS Name: N-(2-chloro-5-nitrophenyl)-2-(3-methyl-4-phenyl-1-pyrazolo[3,4-b]pyridinyl)acetamide IUPAC Name: N-(2-chloro-5-nitrophenyl)-2-(3-methyl-4-phenylpyrazolo[3,4-b]pyridin-1-yl)acetamide Traditional Name: N-(2-chloro-5-nitro-phenyl)-2-(3-methyl-4-phenyl-pyrazolo[3,4-b]pyridin-1-yl)acetamide Formula: C21H16ClN5O3 MolecularWeight: 421.83644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=NC=CC(=C12)C3=CC=CC=C3)CC(=O)NC4=C(C=CC(=C4)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=NN(C2=NC=CC(=C12)C3=CC=CC=C3)CC(=O)NC4=C(C=CC(=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C21H16ClN5O3/c1-13-20-16(14-5-3-2-4-6-14)9-10-23-21(20)26(25-13)12-19(28)24-18-11-15(27(29)30)7-8-17(18)22/h2-11H,12H2,1H3,(H,24,28)