3-(1,4-dihydroisoquinolin-1-yl)propanoic acid

Systemtic Name: 3-(1,4-dihydroisoquinolin-1-yl)propanoic acid Openeye Name: 3-(1,4-dihydroisoquinolin-1-yl)propanoic acid CAS Name: 3-(1,4-dihydroisoquinolin-1-yl)propanoic acid IUPAC Name: 3-(1,4-dihydroisoquinolin-1-yl)propanoic acid Traditional Name: 3-(1,4-dihydroisoquinolin-1-yl)propionic acid Formula: C12H13NO2 MolecularWeight: 203.23712

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Descriptors Computed from Structure

Canonical SMILES:

C1C=NC(C2=CC=CC=C21)CCC(=O)O

Isomeric SMILES

C1C=NC(C2=CC=CC=C21)CCC(=O)O

InChI

InChI=1S/C12H13NO2/c14-12(15)6-5-11-10-4-2-1-3-9(10)7-8-13-11/h1-4,8,11H,5-7H2,(H,14,15)