N-[[3-bromanyl-4-[(4-chlorophenyl)methoxy]-5-methoxy-phenyl]methyl]butan-2-amine hydrochloride

Systemtic Name: N-[[3-bromanyl-4-[(4-chlorophenyl)methoxy]-5-methoxy-phenyl]methyl]butan-2-amine hydrochloride Openeye Name: N-[[3-bromo-4-[(4-chlorophenyl)methoxy]-5-methoxy-phenyl]methyl]butan-2-amine hydrochloride CAS Name: N-[[3-bromo-4-[(4-chlorophenyl)methoxy]-5-methoxyphenyl]methyl]-2-butanamine hydrochloride IUPAC Name: N-[[3-bromo-4-[(4-chlorophenyl)methoxy]-5-methoxyphenyl]methyl]butan-2-amine hydrochloride Traditional Name: [3-bromo-4-(4-chlorobenzyl)oxy-5-methoxy-benzyl]-sec-butyl-amine hydrochloride Formula: C19H24BrCl2NO2 MolecularWeight: 449.20936

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NCC1=CC(=C(C(=C1)Br)OCC2=CC=C(C=C2)Cl)OC.Cl

Isomeric SMILES

CCC(C)NCC1=CC(=C(C(=C1)Br)OCC2=CC=C(C=C2)Cl)OC.Cl

InChI

InChI=1S/C19H23BrClNO2.ClH/c1-4-13(2)22-11-15-9-17(20)19(18(10-15)23-3)24-12-14-5-7-16(21)8-6-14;/h5-10,13,22H,4,11-12H2,1-3H3;1H