3-[(2S)-1-methylpyrrolidin-2-yl]-1-nonyl-pyridin-1-ium

Systemtic Name: 3-[(2S)-1-methylpyrrolidin-2-yl]-1-nonyl-pyridin-1-ium Openeye Name: 3-[(2S)-1-methylpyrrolidin-2-yl]-1-nonyl-pyridin-1-ium CAS Name: 3-[(2S)-1-methyl-2-pyrrolidinyl]-1-nonylpyridin-1-ium IUPAC Name: 3-[(2S)-1-methylpyrrolidin-2-yl]-1-nonylpyridin-1-ium Traditional Name: 3-[(2S)-1-methylpyrrolidin-2-yl]-1-nonyl-pyridin-1-ium Formula: C19H33N2+ MolecularWeight: 289.47872

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC[N+]1=CC=CC(=C1)C2CCCN2C

Isomeric SMILES

CCCCCCCCC[N+]1=CC=CC(=C1)[C@@H]2CCCN2C

InChI

InChI=1S/C19H33N2/c1-3-4-5-6-7-8-9-15-21-16-10-12-18(17-21)19-13-11-14-20(19)2/h10,12,16-17,19H,3-9,11,13-15H2,1-2H3/q+1/t19-/m0/s1