N-[[3-bromanyl-4-[(2-chlorophenyl)methoxy]-5-methoxy-phenyl]methyl]hexan-1-amine

Systemtic Name: N-[[3-bromanyl-4-[(2-chlorophenyl)methoxy]-5-methoxy-phenyl]methyl]hexan-1-amine Openeye Name: N-[[3-bromo-4-[(2-chlorophenyl)methoxy]-5-methoxy-phenyl]methyl]hexan-1-amine CAS Name: N-[[3-bromo-4-[(2-chlorophenyl)methoxy]-5-methoxyphenyl]methyl]-1-hexanamine IUPAC Name: N-[[3-bromo-4-[(2-chlorophenyl)methoxy]-5-methoxyphenyl]methyl]hexan-1-amine Traditional Name: [3-bromo-4-(2-chlorobenzyl)oxy-5-methoxy-benzyl]-hexyl-amine Formula: C21H27BrClNO2 MolecularWeight: 440.80158

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNCC1=CC(=C(C(=C1)Br)OCC2=CC=CC=C2Cl)OC

Isomeric SMILES

CCCCCCNCC1=CC(=C(C(=C1)Br)OCC2=CC=CC=C2Cl)OC

InChI

InChI=1S/C21H27BrClNO2/c1-3-4-5-8-11-24-14-16-12-18(22)21(20(13-16)25-2)26-15-17-9-6-7-10-19(17)23/h6-7,9-10,12-13,24H,3-5,8,11,14-15H2,1-2H3