(1R)-2-(azepan-1-ium-1-yl)-1-thiophen-2-yl-ethanol

Systemtic Name: (1R)-2-(azepan-1-ium-1-yl)-1-thiophen-2-yl-ethanol Openeye Name: (1R)-2-(azepan-1-ium-1-yl)-1-(2-thienyl)ethanol CAS Name: (1R)-2-(1-azepan-1-iumyl)-1-thiophen-2-ylethanol IUPAC Name: (1R)-2-(azepan-1-ium-1-yl)-1-thiophen-2-ylethanol Traditional Name: (1R)-2-(azepan-1-ium-1-yl)-1-(2-thienyl)ethanol Formula: C12H20NOS+ MolecularWeight: 226.3583

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CC1)CC(C2=CC=CS2)O

Isomeric SMILES

C1CCC[NH+](CC1)C[C@H](C2=CC=CS2)O

InChI

InChI=1S/C12H19NOS/c14-11(12-6-5-9-15-12)10-13-7-3-1-2-4-8-13/h5-6,9,11,14H,1-4,7-8,10H2/p+1/t11-/m1/s1