N-butyl-4-(4-chloranyl-2-phenyl-phenoxy)butan-1-amine hydrochloride

Systemtic Name: N-butyl-4-(4-chloranyl-2-phenyl-phenoxy)butan-1-amine hydrochloride Openeye Name: N-butyl-4-(4-chloro-2-phenyl-phenoxy)butan-1-amine hydrochloride CAS Name: N-butyl-4-(4-chloro-2-phenylphenoxy)-1-butanamine hydrochloride IUPAC Name: N-butyl-4-(4-chloro-2-phenylphenoxy)butan-1-amine hydrochloride Traditional Name: butyl-[4-(4-chloro-2-phenyl-phenoxy)butyl]amine hydrochloride Formula: C20H27Cl2NO MolecularWeight: 368.34048

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNCCCCOC1=C(C=C(C=C1)Cl)C2=CC=CC=C2.Cl

Isomeric SMILES

CCCCNCCCCOC1=C(C=C(C=C1)Cl)C2=CC=CC=C2.Cl

InChI

InChI=1S/C20H26ClNO.ClH/c1-2-3-13-22-14-7-8-15-23-20-12-11-18(21)16-19(20)17-9-5-4-6-10-17;/h4-6,9-12,16,22H,2-3,7-8,13-15H2,1H3;1H