(1S)-6,7-dimethoxy-1-methyl-2-[(3-methyl-1-benzothiophen-2-yl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium

Systemtic Name: (1S)-6,7-dimethoxy-1-methyl-2-[(3-methyl-1-benzothiophen-2-yl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium Openeye Name: (1S)-6,7-dimethoxy-1-methyl-2-[(3-methylbenzothiophen-2-yl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium CAS Name: (1S)-6,7-dimethoxy-1-methyl-2-[(3-methyl-1-benzothiophen-2-yl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium IUPAC Name: (1S)-6,7-dimethoxy-1-methyl-2-[(3-methyl-1-benzothiophen-2-yl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium Traditional Name: (1S)-6,7-dimethoxy-1-methyl-2-[(3-methylbenzothiophen-2-yl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium Formula: C22H26NO2S+ MolecularWeight: 368.51234

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=CC(=C(C=C2CC[NH+]1CC3=C(C4=CC=CC=C4S3)C)OC)OC

Isomeric SMILES

C[C@H]1C2=CC(=C(C=C2CC[NH+]1CC3=C(C4=CC=CC=C4S3)C)OC)OC

InChI

InChI=1S/C22H25NO2S/c1-14-17-7-5-6-8-21(17)26-22(14)13-23-10-9-16-11-19(24-3)20(25-4)12-18(16)15(23)2/h5-8,11-12,15H,9-10,13H2,1-4H3/p+1/t15-/m0/s1