2-azanyl-3-isoquinolin-1-yl-propanoic acid

Systemtic Name: 2-azanyl-3-isoquinolin-1-yl-propanoic acid Openeye Name: 2-amino-3-(1-isoquinolyl)propanoic acid CAS Name: 2-amino-3-(1-isoquinolinyl)propanoic acid IUPAC Name: 2-amino-3-isoquinolin-1-ylpropanoic acid Traditional Name: 2-amino-3-(1-isoquinolyl)propionic acid Formula: C12H12N2O2 MolecularWeight: 216.23588

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CN=C2CC(C(=O)O)N

Isomeric SMILES

C1=CC=C2C(=C1)C=CN=C2CC(C(=O)O)N

InChI

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