methyl (3R)-2-[[3-(dimethoxymethyl)phenyl]methyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate

Systemtic Name: methyl (3R)-2-[[3-(dimethoxymethyl)phenyl]methyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate Openeye Name: methyl (3R)-2-[[3-(dimethoxymethyl)phenyl]methyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate CAS Name: (3R)-2-[[3-(dimethoxymethyl)phenyl]methyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester IUPAC Name: methyl (3R)-2-[[3-(dimethoxymethyl)phenyl]methyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate Traditional Name: (3R)-2-[3-(dimethoxymethyl)benzyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester Formula: C21H25NO4 MolecularWeight: 355.4275

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Descriptors Computed from Structure

Canonical SMILES:

COC(C1=CC=CC(=C1)CN2CC3=CC=CC=C3CC2C(=O)OC)OC

Isomeric SMILES

COC(C1=CC=CC(=C1)CN2CC3=CC=CC=C3C[C@@H]2C(=O)OC)OC

InChI

InChI=1S/C21H25NO4/c1-24-20(23)19-12-16-8-4-5-9-18(16)14-22(19)13-15-7-6-10-17(11-15)21(25-2)26-3/h4-11,19,21H,12-14H2,1-3H3/t19-/m1/s1