methyl (2S,3R)-3-oxidanyl-2-[(1R)-2-oxidanyl-3,4-dihydro-1H-isoquinolin-1-yl]butanoate

Systemtic Name: methyl (2S,3R)-3-oxidanyl-2-[(1R)-2-oxidanyl-3,4-dihydro-1H-isoquinolin-1-yl]butanoate Openeye Name: methyl (2S,3R)-3-hydroxy-2-[(1R)-2-hydroxy-3,4-dihydro-1H-isoquinolin-1-yl]butanoate CAS Name: (2S,3R)-3-hydroxy-2-[(1R)-2-hydroxy-3,4-dihydro-1H-isoquinolin-1-yl]butanoic acid methyl ester IUPAC Name: methyl (2S,3R)-3-hydroxy-2-[(1R)-2-hydroxy-3,4-dihydro-1H-isoquinolin-1-yl]butanoate Traditional Name: (2S,3R)-3-hydroxy-2-[(1R)-2-hydroxy-3,4-dihydro-1H-isoquinolin-1-yl]butyric acid methyl ester Formula: C14H19NO4 MolecularWeight: 265.30496

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1C2=CC=CC=C2CCN1O)C(=O)OC)O

Isomeric SMILES

C[C@H]([C@H]([C@@H]1C2=CC=CC=C2CCN1O)C(=O)OC)O

InChI

InChI=1S/C14H19NO4/c1-9(16)12(14(17)19-2)13-11-6-4-3-5-10(11)7-8-15(13)18/h3-6,9,12-13,16,18H,7-8H2,1-2H3/t9-,12-,13+/m1/s1