(2S)-3-methyl-2-(1,2,3,4-tetrahydroisoquinolin-3-ylcarbonylamino)butanoic acid

Systemtic Name: (2S)-3-methyl-2-(1,2,3,4-tetrahydroisoquinolin-3-ylcarbonylamino)butanoic acid Openeye Name: (2S)-3-methyl-2-(1,2,3,4-tetrahydroisoquinoline-3-carbonylamino)butanoic acid CAS Name: (2S)-3-methyl-2-[[oxo(1,2,3,4-tetrahydroisoquinolin-3-yl)methyl]amino]butanoic acid IUPAC Name: (2S)-3-methyl-2-(1,2,3,4-tetrahydroisoquinoline-3-carbonylamino)butanoic acid Traditional Name: (2S)-3-methyl-2-(1,2,3,4-tetrahydroisoquinoline-3-carbonylamino)butyric acid Formula: C15H20N2O3 MolecularWeight: 276.3309

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)C1CC2=CC=CC=C2CN1

Isomeric SMILES

CC(C)[C@@H](C(=O)O)NC(=O)C1CC2=CC=CC=C2CN1

InChI

InChI=1S/C15H20N2O3/c1-9(2)13(15(19)20)17-14(18)12-7-10-5-3-4-6-11(10)8-16-12/h3-6,9,12-13,16H,7-8H2,1-2H3,(H,17,18)(H,19,20)/t12?,13-/m0/s1