3-[[2-(3-butoxyphenyl)quinolin-4-yl]carbonylamino]propyl-diethyl-azanium

Systemtic Name: 3-[[2-(3-butoxyphenyl)quinolin-4-yl]carbonylamino]propyl-diethyl-azanium Openeye Name: 3-[[2-(3-butoxyphenyl)quinoline-4-carbonyl]amino]propyl-diethyl-ammonium CAS Name: 3-[[[2-(3-butoxyphenyl)-4-quinolinyl]-oxomethyl]amino]propyl-diethylammonium IUPAC Name: 3-[[2-(3-butoxyphenyl)quinoline-4-carbonyl]amino]propyl-diethylazanium Traditional Name: 3-[[2-(3-butoxyphenyl)quinoline-4-carbonyl]amino]propyl-diethyl-ammonium Formula: C27H36N3O2+ MolecularWeight: 434.59364

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCCC[NH+](CC)CC

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCCC[NH+](CC)CC

InChI

InChI=1S/C27H35N3O2/c1-4-7-18-32-22-13-10-12-21(19-22)26-20-24(23-14-8-9-15-25(23)29-26)27(31)28-16-11-17-30(5-2)6-3/h8-10,12-15,19-20H,4-7,11,16-18H2,1-3H3,(H,28,31)/p+1