(3S)-N-methyl-3-[3,4,5-tris(chloranyl)phenoxy]hexan-1-amine

Systemtic Name: (3S)-N-methyl-3-[3,4,5-tris(chloranyl)phenoxy]hexan-1-amine Openeye Name: (3S)-N-methyl-3-(3,4,5-trichlorophenoxy)hexan-1-amine CAS Name: (3S)-N-methyl-3-(3,4,5-trichlorophenoxy)-1-hexanamine IUPAC Name: (3S)-N-methyl-3-(3,4,5-trichlorophenoxy)hexan-1-amine Traditional Name: methyl-[(3S)-3-(3,4,5-trichlorophenoxy)hexyl]amine Formula: C13H18Cl3NO MolecularWeight: 310.64712

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18Cl3NO/c1-3-4-9(5-6-17-2)18-10-7-11(14)13(16)12(15)8-10/h7-9,17H,3-6H2,1-2H3/t9-/m0/s1