2-(5-acetamido-2-methyl-3,4-dihydro-1H-isoquinolin-8-yl)propanoic acid

Systemtic Name: 2-(5-acetamido-2-methyl-3,4-dihydro-1H-isoquinolin-8-yl)propanoic acid Openeye Name: 2-(5-acetamido-2-methyl-3,4-dihydro-1H-isoquinolin-8-yl)propanoic acid CAS Name: 2-(5-acetamido-2-methyl-3,4-dihydro-1H-isoquinolin-8-yl)propanoic acid IUPAC Name: 2-(5-acetamido-2-methyl-3,4-dihydro-1H-isoquinolin-8-yl)propanoic acid Traditional Name: 2-(5-acetamido-2-methyl-3,4-dihydro-1H-isoquinolin-8-yl)propionic acid Formula: C15H20N2O3 MolecularWeight: 276.3309

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C2CN(CCC2=C(C=C1)NC(=O)C)C)C(=O)O

Isomeric SMILES

CC(C1=C2CN(CCC2=C(C=C1)NC(=O)C)C)C(=O)O

InChI

InChI=1S/C15H20N2O3/c1-9(15(19)20)11-4-5-14(16-10(2)18)12-6-7-17(3)8-13(11)12/h4-5,9H,6-8H2,1-3H3,(H,16,18)(H,19,20)