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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC(=CC=C3)OCC(C)C

Isomeric SMILES

CC[NH+](CC)CCCNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC(=CC=C3)OCC(C)C

InChI

InChI=1S/C27H35N3O2/c1-5-30(6-2)16-10-15-28-27(31)24-18-26(29-25-14-8-7-13-23(24)25)21-11-9-12-22(17-21)32-19-20(3)4/h7-9,11-14,17-18,20H,5-6,10,15-16,19H2,1-4H3,(H,28,31)/p+1