N-[2-(2-chloranyl-4-methyl-phenoxy)ethyl]butan-1-amine hydrochloride

Systemtic Name: N-[2-(2-chloranyl-4-methyl-phenoxy)ethyl]butan-1-amine hydrochloride Openeye Name: N-[2-(2-chloro-4-methyl-phenoxy)ethyl]butan-1-amine hydrochloride CAS Name: N-[2-(2-chloro-4-methylphenoxy)ethyl]-1-butanamine hydrochloride IUPAC Name: N-[2-(2-chloro-4-methylphenoxy)ethyl]butan-1-amine hydrochloride Traditional Name: butyl-[2-(2-chloro-4-methyl-phenoxy)ethyl]amine hydrochloride Formula: C13H21Cl2NO MolecularWeight: 278.21794

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNCCOC1=C(C=C(C=C1)C)Cl.Cl

Isomeric SMILES

CCCCNCCOC1=C(C=C(C=C1)C)Cl.Cl

InChI

InChI=1S/C13H20ClNO.ClH/c1-3-4-7-15-8-9-16-13-6-5-11(2)10-12(13)14;/h5-6,10,15H,3-4,7-9H2,1-2H3;1H