N-[(4-butoxy-3-chloranyl-5-ethoxy-phenyl)methyl]-2-phenyl-ethanamine hydrochloride

Systemtic Name: N-[(4-butoxy-3-chloranyl-5-ethoxy-phenyl)methyl]-2-phenyl-ethanamine hydrochloride Openeye Name: N-[(4-butoxy-3-chloro-5-ethoxy-phenyl)methyl]-2-phenyl-ethanamine hydrochloride CAS Name: N-[(4-butoxy-3-chloro-5-ethoxyphenyl)methyl]-2-phenylethanamine hydrochloride IUPAC Name: N-[(4-butoxy-3-chloro-5-ethoxyphenyl)methyl]-2-phenylethanamine hydrochloride Traditional Name: (4-butoxy-3-chloro-5-ethoxy-benzyl)-phenethyl-amine hydrochloride Formula: C21H29Cl2NO2 MolecularWeight: 398.36646

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1Cl)CNCCC2=CC=CC=C2)OCC.Cl

Isomeric SMILES

CCCCOC1=C(C=C(C=C1Cl)CNCCC2=CC=CC=C2)OCC.Cl

InChI

InChI=1S/C21H28ClNO2.ClH/c1-3-5-13-25-21-19(22)14-18(15-20(21)24-4-2)16-23-12-11-17-9-7-6-8-10-17;/h6-10,14-15,23H,3-5,11-13,16H2,1-2H3;1H