2-[(3-methyl-1-benzothiophen-2-yl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium

Systemtic Name: 2-[(3-methyl-1-benzothiophen-2-yl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium Openeye Name: 2-[(3-methylbenzothiophen-2-yl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium CAS Name: 2-[(3-methyl-1-benzothiophen-2-yl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium IUPAC Name: 2-[(3-methyl-1-benzothiophen-2-yl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium Traditional Name: 2-[(3-methylbenzothiophen-2-yl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium Formula: C19H20NS+ MolecularWeight: 294.4338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=CC=CC=C12)C[NH+]3CCC4=CC=CC=C4C3

Isomeric SMILES

CC1=C(SC2=CC=CC=C12)C[NH+]3CCC4=CC=CC=C4C3

InChI

InChI=1S/C19H19NS/c1-14-17-8-4-5-9-18(17)21-19(14)13-20-11-10-15-6-2-3-7-16(15)12-20/h2-9H,10-13H2,1H3/p+1