tert-butyl (1R,3S)-5,7-dimethoxy-6-methyl-8-oxidanyl-1-(phenylmethoxymethyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxylate

Systemtic Name: tert-butyl (1R,3S)-5,7-dimethoxy-6-methyl-8-oxidanyl-1-(phenylmethoxymethyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxylate Openeye Name: tert-butyl (1R,3S)-1-(benzyloxymethyl)-8-hydroxy-5,7-dimethoxy-6-methyl-1,2,3,4-tetrahydroisoquinoline-3-carboxylate CAS Name: (1R,3S)-8-hydroxy-5,7-dimethoxy-6-methyl-1-(phenylmethoxymethyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (1R,3S)-8-hydroxy-5,7-dimethoxy-6-methyl-1-(phenylmethoxymethyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxylate Traditional Name: (1R,3S)-1-(benzoxymethyl)-8-hydroxy-5,7-dimethoxy-6-methyl-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid tert-butyl ester Formula: C25H33NO6 MolecularWeight: 443.53262

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C(NC(C2)C(=O)OC(C)(C)C)COCC3=CC=CC=C3)C(=C1OC)O)OC

Isomeric SMILES

CC1=C(C2=C([C@@H](N[C@@H](C2)C(=O)OC(C)(C)C)COCC3=CC=CC=C3)C(=C1OC)O)OC

InChI

InChI=1S/C25H33NO6/c1-15-22(29-5)17-12-18(24(28)32-25(2,3)4)26-19(20(17)21(27)23(15)30-6)14-31-13-16-10-8-7-9-11-16/h7-11,18-19,26-27H,12-14H2,1-6H3/t18-,19-/m0/s1