dimethyl-[2-[[2-oxidanylidene-1-(2-oxidanylpropoxy)quinolin-3-yl]amino]ethyl]-phenyl-azanium

Systemtic Name: dimethyl-[2-[[2-oxidanylidene-1-(2-oxidanylpropoxy)quinolin-3-yl]amino]ethyl]-phenyl-azanium Openeye Name: 2-[[1-(2-hydroxypropoxy)-2-oxo-3-quinolyl]amino]ethyl-dimethyl-phenyl-ammonium CAS Name: 2-[[1-(2-hydroxypropoxy)-2-oxo-3-quinolinyl]amino]ethyl-dimethyl-phenylammonium IUPAC Name: 2-[[1-(2-hydroxypropoxy)-2-oxoquinolin-3-yl]amino]ethyl-dimethyl-phenylazanium Traditional Name: 2-[[1-(2-hydroxypropoxy)-2-keto-3-quinolyl]amino]ethyl-dimethyl-phenyl-ammonium Formula: C22H28N3O3+ MolecularWeight: 382.47602

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Descriptors Computed from Structure

Canonical SMILES:

CC(CON1C2=CC=CC=C2C=C(C1=O)NCC[N+](C)(C)C3=CC=CC=C3)O

Isomeric SMILES

CC(CON1C2=CC=CC=C2C=C(C1=O)NCC[N+](C)(C)C3=CC=CC=C3)O

InChI

InChI=1S/C22H28N3O3/c1-17(26)16-28-24-21-12-8-7-9-18(21)15-20(22(24)27)23-13-14-25(2,3)19-10-5-4-6-11-19/h4-12,15,17,23,26H,13-14,16H2,1-3H3/q+1