tert-butyl (1R)-1-(hydroxymethyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxylate

Systemtic Name: tert-butyl (1R)-1-(hydroxymethyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxylate Openeye Name: tert-butyl (1R)-1-(hydroxymethyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxylate CAS Name: (1R)-1-(hydroxymethyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (1R)-1-(hydroxymethyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxylate Traditional Name: (1R)-6,7-dimethoxy-1-methylol-3,4-dihydro-1H-isoquinoline-2-carboxylic acid tert-butyl ester Formula: C17H25NO5 MolecularWeight: 323.3841

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC2=CC(=C(C=C2C1CO)OC)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC2=CC(=C(C=C2[C@@H]1CO)OC)OC

InChI

InChI=1S/C17H25NO5/c1-17(2,3)23-16(20)18-7-6-11-8-14(21-4)15(22-5)9-12(11)13(18)10-19/h8-9,13,19H,6-7,10H2,1-5H3/t13-/m0/s1