[2-[(2-ethyl-3-methyl-quinolin-4-yl)amino]-2-oxidanylidene-ethyl]-dihexyl-azanium

Systemtic Name: [2-[(2-ethyl-3-methyl-quinolin-4-yl)amino]-2-oxidanylidene-ethyl]-dihexyl-azanium Openeye Name: [2-[(2-ethyl-3-methyl-4-quinolyl)amino]-2-oxo-ethyl]-dihexyl-ammonium CAS Name: [2-[(2-ethyl-3-methyl-4-quinolinyl)amino]-2-oxoethyl]-dihexylammonium IUPAC Name: [2-[(2-ethyl-3-methylquinolin-4-yl)amino]-2-oxoethyl]-dihexylazanium Traditional Name: [2-[(2-ethyl-3-methyl-4-quinolyl)amino]-2-keto-ethyl]-dihexyl-ammonium Formula: C26H42N3O+ MolecularWeight: 412.63118

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC[NH+](CCCCCC)CC(=O)NC1=C(C(=NC2=CC=CC=C21)CC)C

Isomeric SMILES

CCCCCC[NH+](CCCCCC)CC(=O)NC1=C(C(=NC2=CC=CC=C21)CC)C

InChI

InChI=1S/C26H41N3O/c1-5-8-10-14-18-29(19-15-11-9-6-2)20-25(30)28-26-21(4)23(7-3)27-24-17-13-12-16-22(24)26/h12-13,16-17H,5-11,14-15,18-20H2,1-4H3,(H,27,28,30)/p+1