2-[(2-fluorophenyl)carbamoyl-[(6-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[(2-fluorophenyl)carbamoyl-[(6-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]amino]ethyl-dimethyl-azanium Openeye Name: 2-[(2-fluorophenyl)carbamoyl-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[(2-fluoroanilino)-oxomethyl]-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[(2-fluorophenyl)carbamoyl-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]amino]ethyl-dimethylazanium Traditional Name: 2-[(2-fluorophenyl)carbamoyl-[(2-keto-6-methyl-1H-quinolin-3-yl)methyl]amino]ethyl-dimethyl-ammonium Formula: C22H26FN4O2+ MolecularWeight: 397.465843

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC[NH+](C)C)C(=O)NC3=CC=CC=C3F

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC[NH+](C)C)C(=O)NC3=CC=CC=C3F

InChI

InChI=1S/C22H25FN4O2/c1-15-8-9-19-16(12-15)13-17(21(28)24-19)14-27(11-10-26(2)3)22(29)25-20-7-5-4-6-18(20)23/h4-9,12-13H,10-11,14H2,1-3H3,(H,24,28)(H,25,29)/p+1