(3S)-3-[3,5-bis(chloranyl)phenoxy]-N-methyl-hexan-1-amine hydrochloride

Systemtic Name: (3S)-3-[3,5-bis(chloranyl)phenoxy]-N-methyl-hexan-1-amine hydrochloride Openeye Name: (3S)-3-(3,5-dichlorophenoxy)-N-methyl-hexan-1-amine hydrochloride CAS Name: (3S)-3-(3,5-dichlorophenoxy)-N-methyl-1-hexanamine hydrochloride IUPAC Name: (3S)-3-(3,5-dichlorophenoxy)-N-methylhexan-1-amine hydrochloride Traditional Name: [(3S)-3-(3,5-dichlorophenoxy)hexyl]-methyl-amine hydrochloride Formula: C13H20Cl3NO MolecularWeight: 312.663

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19Cl2NO.ClH/c1-3-4-12(5-6-16-2)17-13-8-10(14)7-11(15)9-13;/h7-9,12,16H,3-6H2,1-2H3;1H/t12-;/m0./s1