4-[3,4-dihydro-1H-isoquinolin-2-ylcarbonyl(methyl)amino]butanoic acid

Systemtic Name: 4-[3,4-dihydro-1H-isoquinolin-2-ylcarbonyl(methyl)amino]butanoic acid Openeye Name: 4-[3,4-dihydro-1H-isoquinoline-2-carbonyl(methyl)amino]butanoic acid CAS Name: 4-[[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-methylamino]butanoic acid IUPAC Name: 4-[3,4-dihydro-1H-isoquinoline-2-carbonyl(methyl)amino]butanoic acid Traditional Name: 4-[3,4-dihydro-1H-isoquinoline-2-carbonyl(methyl)amino]butyric acid Formula: C15H20N2O3 MolecularWeight: 276.3309

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(=O)O)C(=O)N1CCC2=CC=CC=C2C1

Isomeric SMILES

CN(CCCC(=O)O)C(=O)N1CCC2=CC=CC=C2C1

InChI

InChI=1S/C15H20N2O3/c1-16(9-4-7-14(18)19)15(20)17-10-8-12-5-2-3-6-13(12)11-17/h2-3,5-6H,4,7-11H2,1H3,(H,18,19)