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

Systemtic Name: 3-chloranyl-2-fluoranyl-N-heptan-4-yl-aniline Openeye Name: 3-chloro-2-fluoro-N-(1-propylbutyl)aniline CAS Name: 3-chloro-2-fluoro-N-heptan-4-ylaniline IUPAC Name: 3-chloro-2-fluoro-N-heptan-4-ylaniline Traditional Name: (3-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/c1-3-6-10(7-4-2)16-12-9-5-8-11(14)13(12)15/h5,8-10,16H,3-4,6-7H2,1-2H3