4-(5-bromanyl-2-phenyl-1H-pyrrolo[2,3-b]pyridin-3-yl)benzoic acid

Systemtic Name: 4-(5-bromanyl-2-phenyl-1H-pyrrolo[2,3-b]pyridin-3-yl)benzoic acid Openeye Name: 4-(5-bromo-2-phenyl-1H-pyrrolo[2,3-b]pyridin-3-yl)benzoic acid CAS Name: 4-(5-bromo-2-phenyl-1H-pyrrolo[2,3-b]pyridin-3-yl)benzoic acid IUPAC Name: 4-(5-bromo-2-phenyl-1H-pyrrolo[2,3-b]pyridin-3-yl)benzoic acid Traditional Name: 4-(5-bromo-2-phenyl-1H-pyrrolo[2,3-b]pyridin-3-yl)benzoic acid Formula: C20H13BrN2O2 MolecularWeight: 393.23342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C3=CC(=CN=C3N2)Br)C4=CC=C(C=C4)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C3=CC(=CN=C3N2)Br)C4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C20H13BrN2O2/c21-15-10-16-17(12-6-8-14(9-7-12)20(24)25)18(23-19(16)22-11-15)13-4-2-1-3-5-13/h1-11H,(H,22,23)(H,24,25)