methyl 3-oxidanyl-2-[(1-oxidanylidene-2H-isoquinolin-3-yl)carbonylamino]propanoate

Systemtic Name: methyl 3-oxidanyl-2-[(1-oxidanylidene-2H-isoquinolin-3-yl)carbonylamino]propanoate Openeye Name: methyl 3-hydroxy-2-[(1-oxo-2H-isoquinoline-3-carbonyl)amino]propanoate CAS Name: 3-hydroxy-2-[[oxo-(1-oxo-2H-isoquinolin-3-yl)methyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-hydroxy-2-[(1-oxo-2H-isoquinoline-3-carbonyl)amino]propanoate Traditional Name: 3-hydroxy-2-[(1-keto-2H-isoquinoline-3-carbonyl)amino]propionic acid methyl ester Formula: C14H14N2O5 MolecularWeight: 290.27136

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CO)NC(=O)C1=CC2=CC=CC=C2C(=O)N1

Isomeric SMILES

COC(=O)C(CO)NC(=O)C1=CC2=CC=CC=C2C(=O)N1

InChI

InChI=1S/C14H14N2O5/c1-21-14(20)11(7-17)16-13(19)10-6-8-4-2-3-5-9(8)12(18)15-10/h2-6,11,17H,7H2,1H3,(H,15,18)(H,16,19)