5-[[(1S)-6,7-dimethoxy-1-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl]methyl]-5-[(2,5-dimethoxyphenyl)methyl]-1,3-dimethyl-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[[(1S)-6,7-dimethoxy-1-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl]methyl]-5-[(2,5-dimethoxyphenyl)methyl]-1,3-dimethyl-1,3-diazinane-2,4,6-trione Openeye Name: 5-[[(1S)-6,7-dimethoxy-1-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl]methyl]-5-[(2,5-dimethoxyphenyl)methyl]-1,3-dimethyl-hexahydropyrimidine-2,4,6-trione CAS Name: 5-[[(1S)-6,7-dimethoxy-1-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl]methyl]-5-[(2,5-dimethoxyphenyl)methyl]-1,3-dimethyl-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[[(1S)-6,7-dimethoxy-1-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl]methyl]-5-[(2,5-dimethoxyphenyl)methyl]-1,3-dimethyl-1,3-diazinane-2,4,6-trione Traditional Name: 5-(2,5-dimethoxybenzyl)-5-[[(1S)-6,7-dimethoxy-1-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl]methyl]-1,3-dimethyl-barbituric acid Formula: C28H36N3O7+ MolecularWeight: 526.60134

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=CC(=C(C=C2CC[NH+]1CC3(C(=O)N(C(=O)N(C3=O)C)C)CC4=C(C=CC(=C4)OC)OC)OC)OC

Isomeric SMILES

C[C@H]1C2=CC(=C(C=C2CC[NH+]1CC3(C(=O)N(C(=O)N(C3=O)C)C)CC4=C(C=CC(=C4)OC)OC)OC)OC

InChI

InChI=1S/C28H35N3O7/c1-17-21-14-24(38-7)23(37-6)13-18(21)10-11-31(17)16-28(25(32)29(2)27(34)30(3)26(28)33)15-19-12-20(35-4)8-9-22(19)36-5/h8-9,12-14,17H,10-11,15-16H2,1-7H3/p+1/t17-/m0/s1