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

Systemtic Name: N-[[5-bromanyl-2-[(4-chlorophenyl)methoxy]phenyl]methyl]heptan-1-amine Openeye Name: N-[[5-bromo-2-[(4-chlorophenyl)methoxy]phenyl]methyl]heptan-1-amine CAS Name: N-[[5-bromo-2-[(4-chlorophenyl)methoxy]phenyl]methyl]-1-heptanamine IUPAC Name: N-[[5-bromo-2-[(4-chlorophenyl)methoxy]phenyl]methyl]heptan-1-amine Traditional Name: [5-bromo-2-(4-chlorobenzyl)oxy-benzyl]-heptyl-amine Formula: C21H27BrClNO MolecularWeight: 424.80218

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNCC1=C(C=CC(=C1)Br)OCC2=CC=C(C=C2)Cl

Isomeric SMILES

CCCCCCCNCC1=C(C=CC(=C1)Br)OCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C21H27BrClNO/c1-2-3-4-5-6-13-24-15-18-14-19(22)9-12-21(18)25-16-17-7-10-20(23)11-8-17/h7-12,14,24H,2-6,13,15-16H2,1H3