2-(2-chloranyl-6-fluoranyl-phenyl)heptane-1,3-diamine

Systemtic Name: 2-(2-chloranyl-6-fluoranyl-phenyl)heptane-1,3-diamine Openeye Name: 2-(2-chloro-6-fluoro-phenyl)heptane-1,3-diamine CAS Name: 2-(2-chloro-6-fluorophenyl)heptane-1,3-diamine IUPAC Name: 2-(2-chloro-6-fluorophenyl)heptane-1,3-diamine Traditional Name: 1-[2-amino-1-(2-chloro-6-fluoro-phenyl)ethyl]pentylamine Formula: C13H20ClFN2 MolecularWeight: 258.762703

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(CN)C1=C(C=CC=C1Cl)F)N

Isomeric SMILES

CCCCC(C(CN)C1=C(C=CC=C1Cl)F)N

InChI

InChI=1S/C13H20ClFN2/c1-2-3-7-12(17)9(8-16)13-10(14)5-4-6-11(13)15/h4-6,9,12H,2-3,7-8,16-17H2,1H3