2-(2-ethanoyl-3,4-dihydro-1H-isoquinolin-1-yl)ethanoic acid

Systemtic Name: 2-(2-ethanoyl-3,4-dihydro-1H-isoquinolin-1-yl)ethanoic acid Openeye Name: 2-(2-acetyl-3,4-dihydro-1H-isoquinolin-1-yl)acetic acid CAS Name: 2-(2-acetyl-3,4-dihydro-1H-isoquinolin-1-yl)acetic acid IUPAC Name: 2-(2-acetyl-3,4-dihydro-1H-isoquinolin-1-yl)acetic acid Traditional Name: 2-(2-acetyl-3,4-dihydro-1H-isoquinolin-1-yl)acetic acid Formula: C13H15NO3 MolecularWeight: 233.2631

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC2=CC=CC=C2C1CC(=O)O

Isomeric SMILES

CC(=O)N1CCC2=CC=CC=C2C1CC(=O)O

InChI

InChI=1S/C13H15NO3/c1-9(15)14-7-6-10-4-2-3-5-11(10)12(14)8-13(16)17/h2-5,12H,6-8H2,1H3,(H,16,17)