2H-isoquinolin-3-one; 4-oxidanyl-1H-pyrimidin-6-one

Systemtic Name: 2H-isoquinolin-3-one; 4-oxidanyl-1H-pyrimidin-6-one Openeye Name: 4-hydroxy-1H-pyrimidin-6-one; 2H-isoquinolin-3-one CAS Name: 4-hydroxy-1H-pyrimidin-6-one; 2H-isoquinolin-3-one IUPAC Name: 4-hydroxy-1H-pyrimidin-6-one; 2H-isoquinolin-3-one Traditional Name: 4-hydroxy-1H-pyrimidin-6-one; 3-isoquinolone Formula: C13H11N3O3 MolecularWeight: 257.24474

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=CC(=O)NC=C2C=C1.C1=C(N=CNC1=O)O

Isomeric SMILES

C1=CC2=CC(=O)NC=C2C=C1.C1=C(N=CNC1=O)O

InChI

InChI=1S/C9H7NO.C4H4N2O2/c11-9-5-7-3-1-2-4-8(7)6-10-9;7-3-1-4(8)6-2-5-3/h1-6H,(H,10,11);1-2H,(H2,5,6,7,8)