2-(5-chloranyl-2-phenethyloxy-phenyl)-1-ethyl-azepane hydrochloride

Systemtic Name: 2-(5-chloranyl-2-phenethyloxy-phenyl)-1-ethyl-azepane hydrochloride Openeye Name: 2-(5-chloro-2-phenethyloxy-phenyl)-1-ethyl-azepane hydrochloride CAS Name: 2-(5-chloro-2-phenethyloxyphenyl)-1-ethylazepane hydrochloride IUPAC Name: 2-(5-chloro-2-phenethyloxyphenyl)-1-ethylazepane hydrochloride Traditional Name: 2-(5-chloro-2-phenethyloxy-phenyl)-1-ethyl-azepane hydrochloride Formula: C22H29Cl2NO MolecularWeight: 394.37776

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCCCC1C2=C(C=CC(=C2)Cl)OCCC3=CC=CC=C3.Cl

Isomeric SMILES

CCN1CCCCCC1C2=C(C=CC(=C2)Cl)OCCC3=CC=CC=C3.Cl

InChI

InChI=1S/C22H28ClNO.ClH/c1-2-24-15-8-4-7-11-21(24)20-17-19(23)12-13-22(20)25-16-14-18-9-5-3-6-10-18;/h3,5-6,9-10,12-13,17,21H,2,4,7-8,11,14-16H2,1H3;1H