tert-butyl-[2-[[2-(dimethylamino)quinolin-1-ium-4-yl]amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: tert-butyl-[2-[[2-(dimethylamino)quinolin-1-ium-4-yl]amino]-2-oxidanylidene-ethyl]azanium Openeye Name: tert-butyl-[2-[[2-(dimethylamino)quinolin-1-ium-4-yl]amino]-2-oxo-ethyl]ammonium CAS Name: tert-butyl-[2-[[2-(dimethylamino)-4-quinolin-1-iumyl]amino]-2-oxoethyl]ammonium IUPAC Name: tert-butyl-[2-[[2-(dimethylamino)quinolin-1-ium-4-yl]amino]-2-oxoethyl]azanium Traditional Name: tert-butyl-[2-[[2-(dimethylamino)quinolin-1-ium-4-yl]amino]-2-keto-ethyl]ammonium Formula: C17H26N4O+2 MolecularWeight: 302.41454

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)[NH2+]CC(=O)NC1=CC(=[NH+]C2=CC=CC=C21)N(C)C

Isomeric SMILES

CC(C)(C)[NH2+]CC(=O)NC1=CC(=[NH+]C2=CC=CC=C21)N(C)C

InChI

InChI=1S/C17H24N4O/c1-17(2,3)18-11-16(22)20-14-10-15(21(4)5)19-13-9-7-6-8-12(13)14/h6-10,18H,11H2,1-5H3,(H,19,20,22)/p+2