2-[[5-azanyl-2-(dimethylamino)phenyl]methyl-(4-fluorophenyl)carbonyl-amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[5-azanyl-2-(dimethylamino)phenyl]methyl-(4-fluorophenyl)carbonyl-amino]ethyl-dimethyl-azanium Openeye Name: 2-[[5-amino-2-(dimethylamino)phenyl]methyl-(4-fluorobenzoyl)amino]ethyl-dimethyl-ammonium CAS Name: 2-[[5-amino-2-(dimethylamino)phenyl]methyl-[(4-fluorophenyl)-oxomethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[5-amino-2-(dimethylamino)phenyl]methyl-(4-fluorobenzoyl)amino]ethyl-dimethylazanium Traditional Name: 2-[[5-amino-2-(dimethylamino)benzyl]-(4-fluorobenzoyl)amino]ethyl-dimethyl-ammonium Formula: C20H28FN4O+ MolecularWeight: 359.460923

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCN(CC1=C(C=CC(=C1)N)N(C)C)C(=O)C2=CC=C(C=C2)F

Isomeric SMILES

C[NH+](C)CCN(CC1=C(C=CC(=C1)N)N(C)C)C(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C20H27FN4O/c1-23(2)11-12-25(20(26)15-5-7-17(21)8-6-15)14-16-13-18(22)9-10-19(16)24(3)4/h5-10,13H,11-12,14,22H2,1-4H3/p+1