methyl (1R)-6,7-dimethoxy-1-(phenylmethyl)-3,4-dihydro-2H-isoquinolin-2-ium-1-carboxylate

Systemtic Name: methyl (1R)-6,7-dimethoxy-1-(phenylmethyl)-3,4-dihydro-2H-isoquinolin-2-ium-1-carboxylate Openeye Name: methyl (1R)-1-benzyl-6,7-dimethoxy-3,4-dihydro-2H-isoquinolin-2-ium-1-carboxylate CAS Name: (1R)-6,7-dimethoxy-1-(phenylmethyl)-3,4-dihydro-2H-isoquinolin-2-ium-1-carboxylic acid methyl ester IUPAC Name: methyl (1R)-1-benzyl-6,7-dimethoxy-3,4-dihydro-2H-isoquinolin-2-ium-1-carboxylate Traditional Name: (1R)-1-benzyl-6,7-dimethoxy-3,4-dihydro-2H-isoquinolin-2-ium-1-carboxylic acid methyl ester Formula: C20H24NO4+ MolecularWeight: 342.40886

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CC[NH2+]C2(CC3=CC=CC=C3)C(=O)OC)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)CC[NH2+][C@@]2(CC3=CC=CC=C3)C(=O)OC)OC

InChI

InChI=1S/C20H23NO4/c1-23-17-11-15-9-10-21-20(19(22)25-3,16(15)12-18(17)24-2)13-14-7-5-4-6-8-14/h4-8,11-12,21H,9-10,13H2,1-3H3/p+1/t20-/m1/s1