2-butyl-3-propyl-quinolin-1-ium-4-amine

Systemtic Name: 2-butyl-3-propyl-quinolin-1-ium-4-amine Openeye Name: 2-butyl-3-propyl-quinolin-1-ium-4-amine CAS Name: 2-butyl-3-propyl-4-quinolin-1-iumamine IUPAC Name: 2-butyl-3-propylquinolin-1-ium-4-amine Traditional Name: (2-butyl-3-propyl-quinolin-1-ium-4-yl)amine Formula: C16H23N2+ MolecularWeight: 243.36722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=[NH+]C2=CC=CC=C2C(=C1CCC)N

Isomeric SMILES

CCCCC1=[NH+]C2=CC=CC=C2C(=C1CCC)N

InChI

InChI=1S/C16H22N2/c1-3-5-10-14-12(8-4-2)16(17)13-9-6-7-11-15(13)18-14/h6-7,9,11H,3-5,8,10H2,1-2H3,(H2,17,18)/p+1