3-bromanyl-1-(phenylmethoxymethyl)-4-(1H-pyrrolo[2,3-b]pyridin-3-yl)pyrrole-2,5-dione

Systemtic Name: 3-bromanyl-1-(phenylmethoxymethyl)-4-(1H-pyrrolo[2,3-b]pyridin-3-yl)pyrrole-2,5-dione Openeye Name: 1-(benzyloxymethyl)-3-bromo-4-(1H-pyrrolo[2,3-b]pyridin-3-yl)pyrrole-2,5-dione CAS Name: 3-bromo-1-(phenylmethoxymethyl)-4-(1H-pyrrolo[2,3-b]pyridin-3-yl)pyrrole-2,5-dione IUPAC Name: 3-bromo-1-(phenylmethoxymethyl)-4-(1H-pyrrolo[2,3-b]pyridin-3-yl)pyrrole-2,5-dione Traditional Name: 1-(benzoxymethyl)-3-bromo-4-(1H-pyrrolo[2,3-b]pyridin-3-yl)-3-pyrroline-2,5-quinone Formula: C19H14BrN3O3 MolecularWeight: 412.23676

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCN2C(=O)C(=C(C2=O)Br)C3=CNC4=C3C=CC=N4

Isomeric SMILES

C1=CC=C(C=C1)COCN2C(=O)C(=C(C2=O)Br)C3=CNC4=C3C=CC=N4

InChI

InChI=1S/C19H14BrN3O3/c20-16-15(14-9-22-17-13(14)7-4-8-21-17)18(24)23(19(16)25)11-26-10-12-5-2-1-3-6-12/h1-9H,10-11H2,(H,21,22)