2-[(1R)-6,7-dimethoxy-1-phenyl-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl]-N-methyl-N-(4-nitrophenyl)ethanamide

Systemtic Name: 2-[(1R)-6,7-dimethoxy-1-phenyl-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl]-N-methyl-N-(4-nitrophenyl)ethanamide Openeye Name: 2-[(1R)-6,7-dimethoxy-1-phenyl-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl]-N-methyl-N-(4-nitrophenyl)acetamide CAS Name: 2-[(1R)-6,7-dimethoxy-1-phenyl-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl]-N-methyl-N-(4-nitrophenyl)acetamide IUPAC Name: 2-[(1R)-6,7-dimethoxy-1-phenyl-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl]-N-methyl-N-(4-nitrophenyl)acetamide Traditional Name: 2-[(1R)-6,7-dimethoxy-1-phenyl-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl]-N-methyl-N-(4-nitrophenyl)acetamide Formula: C26H28N3O5+ MolecularWeight: 462.51762

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)[N+](=O)[O-])C(=O)C[NH+]2CCC3=CC(=C(C=C3C2C4=CC=CC=C4)OC)OC

Isomeric SMILES

CN(C1=CC=C(C=C1)[N+](=O)[O-])C(=O)C[NH+]2CCC3=CC(=C(C=C3[C@H]2C4=CC=CC=C4)OC)OC

InChI

InChI=1S/C26H27N3O5/c1-27(20-9-11-21(12-10-20)29(31)32)25(30)17-28-14-13-19-15-23(33-2)24(34-3)16-22(19)26(28)18-7-5-4-6-8-18/h4-12,15-16,26H,13-14,17H2,1-3H3/p+1/t26-/m1/s1