2-[(8-nitroisoquinolin-5-yl)amino]ethanoic acid

Systemtic Name: 2-[(8-nitroisoquinolin-5-yl)amino]ethanoic acid Openeye Name: 2-[(8-nitro-5-isoquinolyl)amino]acetic acid CAS Name: 2-[(8-nitro-5-isoquinolinyl)amino]acetic acid IUPAC Name: 2-[(8-nitroisoquinolin-5-yl)amino]acetic acid Traditional Name: 2-[(8-nitro-5-isoquinolyl)amino]acetic acid Formula: C11H9N3O4 MolecularWeight: 247.20686

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C=NC=CC2=C1NCC(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C2C=NC=CC2=C1NCC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C11H9N3O4/c15-11(16)6-13-9-1-2-10(14(17)18)8-5-12-4-3-7(8)9/h1-5,13H,6H2,(H,15,16)