6-ethyl-2-piperidin-1-yl-quinolin-1-ium-3-carbonitrile

Systemtic Name: 6-ethyl-2-piperidin-1-yl-quinolin-1-ium-3-carbonitrile Openeye Name: 6-ethyl-2-(1-piperidyl)quinolin-1-ium-3-carbonitrile CAS Name: 6-ethyl-2-(1-piperidinyl)-3-quinolin-1-iumcarbonitrile IUPAC Name: 6-ethyl-2-piperidin-1-ylquinolin-1-ium-3-carbonitrile Traditional Name: 6-ethyl-2-piperidino-quinolin-1-ium-3-carbonitrile Formula: C17H20N3+ MolecularWeight: 266.3608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)[NH+]=C(C(=C2)C#N)N3CCCCC3

Isomeric SMILES

CCC1=CC2=C(C=C1)[NH+]=C(C(=C2)C#N)N3CCCCC3

InChI

InChI=1S/C17H19N3/c1-2-13-6-7-16-14(10-13)11-15(12-18)17(19-16)20-8-4-3-5-9-20/h6-7,10-11H,2-5,8-9H2,1H3/p+1