(1S)-2-piperazin-4-ium-1-yl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol

Systemtic Name: (1S)-2-piperazin-4-ium-1-yl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol Openeye Name: (1S)-2-piperazin-4-ium-1-yl-1-tetralin-6-yl-ethanol CAS Name: (1S)-2-(1-piperazin-4-iumyl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol IUPAC Name: (1S)-2-piperazin-4-ium-1-yl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol Traditional Name: (1S)-2-piperazin-4-ium-1-yl-1-tetralin-6-yl-ethanol Formula: C16H25N2O+ MolecularWeight: 261.3825

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=CC(=C2)C(CN3CC[NH2+]CC3)O

Isomeric SMILES

C1CCC2=C(C1)C=CC(=C2)[C@@H](CN3CC[NH2+]CC3)O

InChI

InChI=1S/C16H24N2O/c19-16(12-18-9-7-17-8-10-18)15-6-5-13-3-1-2-4-14(13)11-15/h5-6,11,16-17,19H,1-4,7-10,12H2/p+1/t16-/m1/s1