N-tert-butyl-5-(4-chloranyl-2-phenyl-phenoxy)pentan-1-amine hydrochloride

Systemtic Name: N-tert-butyl-5-(4-chloranyl-2-phenyl-phenoxy)pentan-1-amine hydrochloride Openeye Name: N-tert-butyl-5-(4-chloro-2-phenyl-phenoxy)pentan-1-amine hydrochloride CAS Name: N-tert-butyl-5-(4-chloro-2-phenylphenoxy)-1-pentanamine hydrochloride IUPAC Name: N-tert-butyl-5-(4-chloro-2-phenylphenoxy)pentan-1-amine hydrochloride Traditional Name: tert-butyl-[5-(4-chloro-2-phenyl-phenoxy)pentyl]amine hydrochloride Formula: C21H29Cl2NO MolecularWeight: 382.36706

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCCCCCOC1=C(C=C(C=C1)Cl)C2=CC=CC=C2.Cl

Isomeric SMILES

CC(C)(C)NCCCCCOC1=C(C=C(C=C1)Cl)C2=CC=CC=C2.Cl

InChI

InChI=1S/C21H28ClNO.ClH/c1-21(2,3)23-14-8-5-9-15-24-20-13-12-18(22)16-19(20)17-10-6-4-7-11-17;/h4,6-7,10-13,16,23H,5,8-9,14-15H2,1-3H3;1H