(3S)-3-(3-chloranyl-4-fluoranyl-phenoxy)-N-methyl-hexan-1-amine hydrochloride

Systemtic Name: (3S)-3-(3-chloranyl-4-fluoranyl-phenoxy)-N-methyl-hexan-1-amine hydrochloride Openeye Name: (3S)-3-(3-chloro-4-fluoro-phenoxy)-N-methyl-hexan-1-amine hydrochloride CAS Name: (3S)-3-(3-chloro-4-fluorophenoxy)-N-methyl-1-hexanamine hydrochloride IUPAC Name: (3S)-3-(3-chloro-4-fluorophenoxy)-N-methylhexan-1-amine hydrochloride Traditional Name: [(3S)-3-(3-chloro-4-fluoro-phenoxy)hexyl]-methyl-amine hydrochloride Formula: C13H20Cl2FNO MolecularWeight: 296.208403

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCNC)OC1=CC(=C(C=C1)F)Cl.Cl

Isomeric SMILES

CCC[C@@H](CCNC)OC1=CC(=C(C=C1)F)Cl.Cl

InChI

InChI=1S/C13H19ClFNO.ClH/c1-3-4-10(7-8-16-2)17-11-5-6-13(15)12(14)9-11;/h5-6,9-10,16H,3-4,7-8H2,1-2H3;1H/t10-;/m0./s1