(2-chloranyl-6-fluoranyl-phenyl)methyl-cyclopropyl-[2-(6-nitro-3,4-dihydro-2H-quinolin-1-yl)-2-oxidanylidene-ethyl]azanium

Systemtic Name: (2-chloranyl-6-fluoranyl-phenyl)methyl-cyclopropyl-[2-(6-nitro-3,4-dihydro-2H-quinolin-1-yl)-2-oxidanylidene-ethyl]azanium Openeye Name: (2-chloro-6-fluoro-phenyl)methyl-cyclopropyl-[2-(6-nitro-3,4-dihydro-2H-quinolin-1-yl)-2-oxo-ethyl]ammonium CAS Name: (2-chloro-6-fluorophenyl)methyl-cyclopropyl-[2-(6-nitro-3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]ammonium IUPAC Name: (2-chloro-6-fluorophenyl)methyl-cyclopropyl-[2-(6-nitro-3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]azanium Traditional Name: (2-chloro-6-fluoro-benzyl)-cyclopropyl-[2-keto-2-(6-nitro-3,4-dihydro-2H-quinolin-1-yl)ethyl]ammonium Formula: C21H22ClFN3O3+ MolecularWeight: 418.869083

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2)[N+](=O)[O-])N(C1)C(=O)C[NH+](CC3=C(C=CC=C3Cl)F)C4CC4

Isomeric SMILES

C1CC2=C(C=CC(=C2)[N+](=O)[O-])N(C1)C(=O)C[NH+](CC3=C(C=CC=C3Cl)F)C4CC4

InChI

InChI=1S/C21H21ClFN3O3/c22-18-4-1-5-19(23)17(18)12-24(15-6-7-15)13-21(27)25-10-2-3-14-11-16(26(28)29)8-9-20(14)25/h1,4-5,8-9,11,15H,2-3,6-7,10,12-13H2/p+1