3-[2-(diethylamino)-8-methyl-quinolin-1-ium-3-yl]propanenitrile

Systemtic Name: 3-[2-(diethylamino)-8-methyl-quinolin-1-ium-3-yl]propanenitrile Openeye Name: 3-[2-(diethylamino)-8-methyl-quinolin-1-ium-3-yl]propanenitrile CAS Name: 3-[2-(diethylamino)-8-methyl-3-quinolin-1-iumyl]propanenitrile IUPAC Name: 3-[2-(diethylamino)-8-methylquinolin-1-ium-3-yl]propanenitrile Traditional Name: 3-[2-(diethylamino)-8-methyl-quinolin-1-ium-3-yl]propionitrile Formula: C17H22N3+ MolecularWeight: 268.37668

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(C=C2C=CC=C(C2=[NH+]1)C)CCC#N

Isomeric SMILES

CCN(CC)C1=C(C=C2C=CC=C(C2=[NH+]1)C)CCC#N

InChI

InChI=1S/C17H21N3/c1-4-20(5-2)17-15(10-7-11-18)12-14-9-6-8-13(3)16(14)19-17/h6,8-9,12H,4-5,7,10H2,1-3H3/p+1