(2R)-3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]-2-methyl-propanoate

Systemtic Name: (2R)-3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]-2-methyl-propanoate Openeye Name: (2R)-3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]-2-methyl-propanoate CAS Name: (2R)-3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]-2-methylpropanoate IUPAC Name: (2R)-3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]-2-methylpropanoate Traditional Name: (2R)-3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]-2-methyl-propionate Formula: C15H20NO6S- MolecularWeight: 342.3874

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Descriptors Computed from Structure

Canonical SMILES:

CC(CS(=O)(=O)N1CCC2=CC(=C(C=C2C1)OC)OC)C(=O)[O-]

Isomeric SMILES

C[C@@H](CS(=O)(=O)N1CCC2=CC(=C(C=C2C1)OC)OC)C(=O)[O-]

InChI

InChI=1S/C15H21NO6S/c1-10(15(17)18)9-23(19,20)16-5-4-11-6-13(21-2)14(22-3)7-12(11)8-16/h6-7,10H,4-5,8-9H2,1-3H3,(H,17,18)/p-1/t10-/m0/s1