4-(4-pyrrol-1-ylpiperidin-1-yl)-2-(trifluoromethyl)quinolin-1-ium

Systemtic Name: 4-(4-pyrrol-1-ylpiperidin-1-yl)-2-(trifluoromethyl)quinolin-1-ium Openeye Name: 4-(4-pyrrol-1-yl-1-piperidyl)-2-(trifluoromethyl)quinolin-1-ium CAS Name: 4-[4-(1-pyrrolyl)-1-piperidinyl]-2-(trifluoromethyl)quinolin-1-ium IUPAC Name: 4-(4-pyrrol-1-ylpiperidin-1-yl)-2-(trifluoromethyl)quinolin-1-ium Traditional Name: 4-(4-pyrrol-1-ylpiperidino)-2-(trifluoromethyl)quinolin-1-ium Formula: C19H19F3N3+ MolecularWeight: 346.36947

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C=CC=C2)C3=CC(=[NH+]C4=CC=CC=C43)C(F)(F)F

Isomeric SMILES

C1CN(CCC1N2C=CC=C2)C3=CC(=[NH+]C4=CC=CC=C43)C(F)(F)F

InChI

InChI=1S/C19H18F3N3/c20-19(21,22)18-13-17(15-5-1-2-6-16(15)23-18)25-11-7-14(8-12-25)24-9-3-4-10-24/h1-6,9-10,13-14H,7-8,11-12H2/p+1