4-[(3-bromophenyl)amino]-1-phenyl-pyrazolo[3,4-b]pyridine-5-carboxylic acid

Systemtic Name: 4-[(3-bromophenyl)amino]-1-phenyl-pyrazolo[3,4-b]pyridine-5-carboxylic acid Openeye Name: 4-(3-bromoanilino)-1-phenyl-pyrazolo[3,4-b]pyridine-5-carboxylic acid CAS Name: 4-(3-bromoanilino)-1-phenyl-5-pyrazolo[3,4-b]pyridinecarboxylic acid IUPAC Name: 4-(3-bromoanilino)-1-phenylpyrazolo[3,4-b]pyridine-5-carboxylic acid Traditional Name: 4-(3-bromoanilino)-1-phenyl-pyrazolo[3,4-b]pyridine-5-carboxylic acid Formula: C19H13BrN4O2 MolecularWeight: 409.23612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C3=NC=C(C(=C3C=N2)NC4=CC(=CC=C4)Br)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)N2C3=NC=C(C(=C3C=N2)NC4=CC(=CC=C4)Br)C(=O)O

InChI

InChI=1S/C19H13BrN4O2/c20-12-5-4-6-13(9-12)23-17-15-11-22-24(14-7-2-1-3-8-14)18(15)21-10-16(17)19(25)26/h1-11H,(H,21,23)(H,25,26)