N-tert-butyl-6-(4-chloranyl-2-phenyl-phenoxy)hexan-1-amine hydrochloride

Systemtic Name: N-tert-butyl-6-(4-chloranyl-2-phenyl-phenoxy)hexan-1-amine hydrochloride Openeye Name: N-tert-butyl-6-(4-chloro-2-phenyl-phenoxy)hexan-1-amine hydrochloride CAS Name: N-tert-butyl-6-(4-chloro-2-phenylphenoxy)-1-hexanamine hydrochloride IUPAC Name: N-tert-butyl-6-(4-chloro-2-phenylphenoxy)hexan-1-amine hydrochloride Traditional Name: tert-butyl-[6-(4-chloro-2-phenyl-phenoxy)hexyl]amine hydrochloride Formula: C22H31Cl2NO MolecularWeight: 396.39364

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCCCCCCOC1=C(C=C(C=C1)Cl)C2=CC=CC=C2.Cl

Isomeric SMILES

CC(C)(C)NCCCCCCOC1=C(C=C(C=C1)Cl)C2=CC=CC=C2.Cl

InChI

InChI=1S/C22H30ClNO.ClH/c1-22(2,3)24-15-9-4-5-10-16-25-21-14-13-19(23)17-20(21)18-11-7-6-8-12-18;/h6-8,11-14,17,24H,4-5,9-10,15-16H2,1-3H3;1H