1-(nitromethyl)-3H-isoquinolin-4-one

Systemtic Name: 1-(nitromethyl)-3H-isoquinolin-4-one Openeye Name: 1-(nitromethyl)-3H-isoquinolin-4-one CAS Name: 1-(nitromethyl)-3H-isoquinolin-4-one IUPAC Name: 1-(nitromethyl)-3H-isoquinolin-4-one Traditional Name: 1-(nitromethyl)-3H-isoquinolin-4-one Formula: C10H8N2O3 MolecularWeight: 204.18212

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)C2=CC=CC=C2C(=N1)C[N+](=O)[O-]

Isomeric SMILES

C1C(=O)C2=CC=CC=C2C(=N1)C[N+](=O)[O-]

InChI

InChI=1S/C10H8N2O3/c13-10-5-11-9(6-12(14)15)7-3-1-2-4-8(7)10/h1-4H,5-6H2