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

Systemtic Name: O2-tert-butyl O1-methyl (1R)-6-[2-(3-methoxyphenyl)ethoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate Openeye Name: O2-tert-butyl O1-methyl (1R)-6-[2-(3-methoxyphenyl)ethoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate CAS Name: (1R)-6-[2-(3-methoxyphenyl)ethoxy]-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-[2-(3-methoxyphenyl)ethoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate Traditional Name: (1R)-6-[2-(3-methoxyphenyl)ethoxy]-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:

CC(C)(C)OC(=O)N1CCC2=C(C1C(=O)OC)C=CC(=C2)OCCC3=CC(=CC=C3)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC2=C([C@@H]1C(=O)OC)C=CC(=C2)OCCC3=CC(=CC=C3)OC

InChI

InChI=1S/C25H31NO6/c1-25(2,3)32-24(28)26-13-11-18-16-20(9-10-21(18)22(26)23(27)30-5)31-14-12-17-7-6-8-19(15-17)29-4/h6-10,15-16,22H,11-14H2,1-5H3/t22-/m1/s1