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

Systemtic Name: 2-[(1S)-6,7-dimethoxy-1-thiophen-2-yl-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl]-N-(4-methyl-2-nitro-phenyl)ethanamide Openeye Name: 2-[(1S)-6,7-dimethoxy-1-(2-thienyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl]-N-(4-methyl-2-nitro-phenyl)acetamide CAS Name: 2-[(1S)-6,7-dimethoxy-1-thiophen-2-yl-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl]-N-(4-methyl-2-nitrophenyl)acetamide IUPAC Name: 2-[(1S)-6,7-dimethoxy-1-thiophen-2-yl-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl]-N-(4-methyl-2-nitrophenyl)acetamide Traditional Name: 2-[(1S)-6,7-dimethoxy-1-(2-thienyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl]-N-(4-methyl-2-nitro-phenyl)acetamide Formula: C24H26N3O5S+ MolecularWeight: 468.54534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C[NH+]2CCC3=CC(=C(C=C3C2C4=CC=CS4)OC)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C[NH+]2CCC3=CC(=C(C=C3[C@H]2C4=CC=CS4)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C24H25N3O5S/c1-15-6-7-18(19(11-15)27(29)30)25-23(28)14-26-9-8-16-12-20(31-2)21(32-3)13-17(16)24(26)22-5-4-10-33-22/h4-7,10-13,24H,8-9,14H2,1-3H3,(H,25,28)/p+1/t24-/m0/s1