2-azanyl-9-[[(2E)-2-hydroxyiminoethoxy]methyl]-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[[(2E)-2-hydroxyiminoethoxy]methyl]-3H-purin-6-one Openeye Name: (1E)-2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]acetaldehyde oxime CAS Name: (1E)-2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]acetaldehyde oxime IUPAC Name: 2-amino-9-[[(2E)-2-hydroxyiminoethoxy]methyl]-3H-purin-6-one Traditional Name: (1E)-2-[(2-amino-6-keto-3H-purin-9-yl)methoxy]acetaldoxime Formula: C8H10N6O3 MolecularWeight: 238.2034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1COCC=NO)NC(=NC2=O)N

Isomeric SMILES

C1=NC2=C(N1COC/C=N/O)NC(=NC2=O)N

InChI

InChI=1S/C8H10N6O3/c9-8-12-6-5(7(15)13-8)10-3-14(6)4-17-2-1-11-16/h1,3,16H,2,4H2,(H3,9,12,13,15)/b11-1+