3-isoquinolin-2-ium-2-ylpropan-1-ol

Systemtic Name: 3-isoquinolin-2-ium-2-ylpropan-1-ol Openeye Name: 3-isoquinolin-2-ium-2-ylpropan-1-ol CAS Name: 3-(2-isoquinolin-2-iumyl)-1-propanol IUPAC Name: 3-isoquinolin-2-ium-2-ylpropan-1-ol Traditional Name: 3-isoquinolin-2-ium-2-ylpropan-1-ol Formula: C12H14NO+ MolecularWeight: 188.24566

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=[N+](C=CC2=C1)CCCO

Isomeric SMILES

C1=CC=C2C=[N+](C=CC2=C1)CCCO

InChI

InChI=1S/C12H14NO/c14-9-3-7-13-8-6-11-4-1-2-5-12(11)10-13/h1-2,4-6,8,10,14H,3,7,9H2/q+1