[7-[(3-chloranyl-4-fluoranyl-phenyl)amino]-7-oxidanylidene-heptyl]azanium

Systemtic Name: [7-[(3-chloranyl-4-fluoranyl-phenyl)amino]-7-oxidanylidene-heptyl]azanium Openeye Name: [7-(3-chloro-4-fluoro-anilino)-7-oxo-heptyl]ammonium CAS Name: [7-(3-chloro-4-fluoroanilino)-7-oxoheptyl]ammonium IUPAC Name: [7-(3-chloro-4-fluoroanilino)-7-oxoheptyl]azanium Traditional Name: [7-(3-chloro-4-fluoro-anilino)-7-keto-heptyl]ammonium Formula: C13H19ClFN2O+ MolecularWeight: 273.754163

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC(=O)CCCCCC[NH3+])Cl)F

Isomeric SMILES

C1=CC(=C(C=C1NC(=O)CCCCCC[NH3+])Cl)F

InChI

InChI=1S/C13H18ClFN2O/c14-11-9-10(6-7-12(11)15)17-13(18)5-3-1-2-4-8-16/h6-7,9H,1-5,8,16H2,(H,17,18)/p+1