butyl-methyl-[[7-methyl-2-oxidanylidene-1-(pyridin-2-ylmethyl)quinolin-3-yl]methyl]azanium

Systemtic Name: butyl-methyl-[[7-methyl-2-oxidanylidene-1-(pyridin-2-ylmethyl)quinolin-3-yl]methyl]azanium Openeye Name: butyl-methyl-[[7-methyl-2-oxo-1-(2-pyridylmethyl)-3-quinolyl]methyl]ammonium CAS Name: butyl-methyl-[[7-methyl-2-oxo-1-(2-pyridinylmethyl)-3-quinolinyl]methyl]ammonium IUPAC Name: butyl-methyl-[[7-methyl-2-oxo-1-(pyridin-2-ylmethyl)quinolin-3-yl]methyl]azanium Traditional Name: butyl-[[2-keto-7-methyl-1-(2-pyridylmethyl)-3-quinolyl]methyl]-methyl-ammonium Formula: C22H28N3O+ MolecularWeight: 350.47722

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](C)CC1=CC2=C(C=C(C=C2)C)N(C1=O)CC3=CC=CC=N3

Isomeric SMILES

CCCC[NH+](C)CC1=CC2=C(C=C(C=C2)C)N(C1=O)CC3=CC=CC=N3

InChI

InChI=1S/C22H27N3O/c1-4-5-12-24(3)15-19-14-18-10-9-17(2)13-21(18)25(22(19)26)16-20-8-6-7-11-23-20/h6-11,13-14H,4-5,12,15-16H2,1-3H3/p+1