O2-tert-butyl O1-methyl (1R)-6-[(4-methoxy-3-methyl-phenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate

Systemtic Name: O2-tert-butyl O1-methyl (1R)-6-[(4-methoxy-3-methyl-phenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate Openeye Name: O2-tert-butyl O1-methyl (1R)-6-[(4-methoxy-3-methyl-phenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate CAS Name: (1R)-6-[(4-methoxy-3-methylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylic acid O2-tert-butyl ester O1-methyl ester IUPAC Name: 2-O-tert-butyl 1-O-methyl (1R)-6-[(4-methoxy-3-methylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate Traditional Name: (1R)-6-(4-methoxy-3-methyl-benzyl)oxy-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylic acid O2-tert-butyl ester O1-methyl ester Formula: C25H31NO6 MolecularWeight: 441.51674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)COC2=CC3=C(C=C2)C(N(CC3)C(=O)OC(C)(C)C)C(=O)OC)OC

Isomeric SMILES

CC1=C(C=CC(=C1)COC2=CC3=C(C=C2)[C@@H](N(CC3)C(=O)OC(C)(C)C)C(=O)OC)OC

InChI

InChI=1S/C25H31NO6/c1-16-13-17(7-10-21(16)29-5)15-31-19-8-9-20-18(14-19)11-12-26(22(20)23(27)30-6)24(28)32-25(2,3)4/h7-10,13-14,22H,11-12,15H2,1-6H3/t22-/m1/s1