2-[(4-oxidanylisoquinolin-3-yl)carbonylamino]ethanoic acid

Systemtic Name: 2-[(4-oxidanylisoquinolin-3-yl)carbonylamino]ethanoic acid Openeye Name: 2-[(4-hydroxyisoquinoline-3-carbonyl)amino]acetic acid CAS Name: 2-[[(4-hydroxy-3-isoquinolinyl)-oxomethyl]amino]acetic acid IUPAC Name: 2-[(4-hydroxyisoquinoline-3-carbonyl)amino]acetic acid Traditional Name: 2-[(4-hydroxyisoquinoline-3-carbonyl)amino]acetic acid Formula: C12H10N2O4 MolecularWeight: 246.2188

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=NC(=C2O)C(=O)NCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=NC(=C2O)C(=O)NCC(=O)O

InChI

InChI=1S/C12H10N2O4/c15-9(16)6-14-12(18)10-11(17)8-4-2-1-3-7(8)5-13-10/h1-5,17H,6H2,(H,14,18)(H,15,16)