2-azanyl-3-isoquinolin-6-yl-propanoic acid

Systemtic Name: 2-azanyl-3-isoquinolin-6-yl-propanoic acid Openeye Name: 2-amino-3-(6-isoquinolyl)propanoic acid CAS Name: 2-amino-3-(6-isoquinolinyl)propanoic acid IUPAC Name: 2-amino-3-isoquinolin-6-ylpropanoic acid Traditional Name: 2-amino-3-(6-isoquinolyl)propionic acid Formula: C12H12N2O2 MolecularWeight: 216.23588

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CN=C2)C=C1CC(C(=O)O)N

Isomeric SMILES

C1=CC2=C(C=CN=C2)C=C1CC(C(=O)O)N

InChI

InChI=1S/C12H12N2O2/c13-11(12(15)16)6-8-1-2-10-7-14-4-3-9(10)5-8/h1-5,7,11H,6,13H2,(H,15,16)