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

Systemtic Name: O2-tert-butyl O1-methyl (1R)-6-[(3-methoxycarbonylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate Openeye Name: O2-tert-butyl O1-methyl (1R)-6-[(3-methoxycarbonylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate CAS Name: (1R)-6-[(3-methoxycarbonylphenyl)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-[(3-methoxycarbonylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate Traditional Name: (1R)-6-(3-carbomethoxybenzyl)oxy-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylic acid O2-tert-butyl ester O1-methyl ester Formula: C25H29NO7 MolecularWeight: 455.50026

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC2=C(C1C(=O)OC)C=CC(=C2)OCC3=CC=CC(=C3)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC2=C([C@@H]1C(=O)OC)C=CC(=C2)OCC3=CC=CC(=C3)C(=O)OC

InChI

InChI=1S/C25H29NO7/c1-25(2,3)33-24(29)26-12-11-17-14-19(9-10-20(17)21(26)23(28)31-5)32-15-16-7-6-8-18(13-16)22(27)30-4/h6-10,13-14,21H,11-12,15H2,1-5H3/t21-/m1/s1