5-chloranyl-2-fluoranyl-N-heptan-4-yl-aniline

Systemtic Name: 5-chloranyl-2-fluoranyl-N-heptan-4-yl-aniline Openeye Name: 5-chloro-2-fluoro-N-(1-propylbutyl)aniline CAS Name: 5-chloro-2-fluoro-N-heptan-4-ylaniline IUPAC Name: 5-chloro-2-fluoro-N-heptan-4-ylaniline Traditional Name: (5-chloro-2-fluoro-phenyl)-(1-propylbutyl)amine Formula: C13H19ClFN MolecularWeight: 243.748063

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)NC1=C(C=CC(=C1)Cl)F

Isomeric SMILES

CCCC(CCC)NC1=C(C=CC(=C1)Cl)F

InChI

InChI=1S/C13H19ClFN/c1-3-5-11(6-4-2)16-13-9-10(14)7-8-12(13)15/h7-9,11,16H,3-6H2,1-2H3