2-[[3-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)oxiran-2-yl]carbonyl-(methylamino)amino]ethanoic acid

Systemtic Name: 2-[[3-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)oxiran-2-yl]carbonyl-(methylamino)amino]ethanoic acid Openeye Name: 2-[[3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)oxirane-2-carbonyl]-(methylamino)amino]acetic acid CAS Name: 2-[[[3-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-2-oxiranyl]-oxomethyl]-(methylamino)amino]acetic acid IUPAC Name: 2-[[3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)oxirane-2-carbonyl]-(methylamino)amino]acetic acid Traditional Name: 2-[[3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)oxirane-2-carbonyl]-(methylamino)amino]acetic acid Formula: C16H19N3O5 MolecularWeight: 333.33916

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Descriptors Computed from Structure

Canonical SMILES:

CNN(CC(=O)O)C(=O)C1C(O1)C(=O)N2CCC3=CC=CC=C3C2

Isomeric SMILES

CNN(CC(=O)O)C(=O)C1C(O1)C(=O)N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C16H19N3O5/c1-17-19(9-12(20)21)16(23)14-13(24-14)15(22)18-7-6-10-4-2-3-5-11(10)8-18/h2-5,13-14,17H,6-9H2,1H3,(H,20,21)