(2S)-1-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)-2-thiophen-2-yl-propan-2-ol

Systemtic Name: (2S)-1-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)-2-thiophen-2-yl-propan-2-ol Openeye Name: (2S)-1-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)-2-(2-thienyl)propan-2-ol CAS Name: (2S)-1-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)-2-thiophen-2-yl-2-propanol IUPAC Name: (2S)-1-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)-2-thiophen-2-ylpropan-2-ol Traditional Name: (2S)-1-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)-2-(2-thienyl)propan-2-ol Formula: C16H20NOS+ MolecularWeight: 274.4011

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Descriptors Computed from Structure

Canonical SMILES:

CC(C[NH+]1CCC2=CC=CC=C2C1)(C3=CC=CS3)O

Isomeric SMILES

C[C@](C[NH+]1CCC2=CC=CC=C2C1)(C3=CC=CS3)O

InChI

InChI=1S/C16H19NOS/c1-16(18,15-7-4-10-19-15)12-17-9-8-13-5-2-3-6-14(13)11-17/h2-7,10,18H,8-9,11-12H2,1H3/p+1/t16-/m0/s1