methyl 2-(3,4-dihydro-1H-isoquinolin-2-ylsulfonylamino)-3-oxidanyl-propanoate

Systemtic Name: methyl 2-(3,4-dihydro-1H-isoquinolin-2-ylsulfonylamino)-3-oxidanyl-propanoate Openeye Name: methyl 2-(3,4-dihydro-1H-isoquinolin-2-ylsulfonylamino)-3-hydroxy-propanoate CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylsulfonylamino)-3-hydroxypropanoic acid methyl ester IUPAC Name: methyl 2-(3,4-dihydro-1H-isoquinolin-2-ylsulfonylamino)-3-hydroxypropanoate Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylsulfonylamino)-3-hydroxy-propionic acid methyl ester Formula: C13H18N2O5S MolecularWeight: 314.35742

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CO)NS(=O)(=O)N1CCC2=CC=CC=C2C1

Isomeric SMILES

COC(=O)C(CO)NS(=O)(=O)N1CCC2=CC=CC=C2C1

InChI

InChI=1S/C13H18N2O5S/c1-20-13(17)12(9-16)14-21(18,19)15-7-6-10-4-2-3-5-11(10)8-15/h2-5,12,14,16H,6-9H2,1H3