tert-butyl 6-methoxy-4-(methylsulfonyloxymethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylate

Systemtic Name: tert-butyl 6-methoxy-4-(methylsulfonyloxymethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylate Openeye Name: tert-butyl 6-methoxy-4-(methylsulfonyloxymethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylate CAS Name: 6-methoxy-4-(methylsulfonyloxymethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 6-methoxy-4-(methylsulfonyloxymethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylate Traditional Name: 6-methoxy-4-(methylsulfonyloxymethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylic acid tert-butyl ester Formula: C17H25NO6S MolecularWeight: 371.4485

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(C2=C(C1)C=CC(=C2)OC)COS(=O)(=O)C

Isomeric SMILES

CC(C)(C)OC(=O)N1CC(C2=C(C1)C=CC(=C2)OC)COS(=O)(=O)C

InChI

InChI=1S/C17H25NO6S/c1-17(2,3)24-16(19)18-9-12-6-7-14(22-4)8-15(12)13(10-18)11-23-25(5,20)21/h6-8,13H,9-11H2,1-5H3