8-bromanyl-2-[(2S,4R)-4-oxidanylpyrrolidin-2-yl]-1H-[1]benzofuro[3,2-d]pyrimidin-4-one

Systemtic Name: 8-bromanyl-2-[(2S,4R)-4-oxidanylpyrrolidin-2-yl]-1H-[1]benzofuro[3,2-d]pyrimidin-4-one Openeye Name: 8-bromo-2-[(2S,4R)-4-hydroxypyrrolidin-2-yl]-1H-benzofuro[3,2-d]pyrimidin-4-one CAS Name: 8-bromo-2-[(2S,4R)-4-hydroxy-2-pyrrolidinyl]-1H-benzofuro[3,2-d]pyrimidin-4-one IUPAC Name: 8-bromo-2-[(2S,4R)-4-hydroxypyrrolidin-2-yl]-1H-[1]benzofuro[3,2-d]pyrimidin-4-one Traditional Name: 8-bromo-2-[(2S,4R)-4-hydroxypyrrolidin-2-yl]-1H-benzofuro[3,2-d]pyrimidin-4-one Formula: C14H12BrN3O3 MolecularWeight: 350.16738

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CNC1C2=NC(=O)C3=C(N2)C4=C(O3)C=CC(=C4)Br)O

Isomeric SMILES

C1[C@H](CN[C@@H]1C2=NC(=O)C3=C(N2)C4=C(O3)C=CC(=C4)Br)O

InChI

InChI=1S/C14H12BrN3O3/c15-6-1-2-10-8(3-6)11-12(21-10)14(20)18-13(17-11)9-4-7(19)5-16-9/h1-3,7,9,16,19H,4-5H2,(H,17,18,20)/t7-,9+/m1/s1