[5-bromanyl-2-[(4-chlorophenyl)methoxy]phenyl]methyl-propyl-azanium

Systemtic Name: [5-bromanyl-2-[(4-chlorophenyl)methoxy]phenyl]methyl-propyl-azanium Openeye Name: [5-bromo-2-[(4-chlorophenyl)methoxy]phenyl]methyl-propyl-ammonium CAS Name: [5-bromo-2-[(4-chlorophenyl)methoxy]phenyl]methyl-propylammonium IUPAC Name: [5-bromo-2-[(4-chlorophenyl)methoxy]phenyl]methyl-propylazanium Traditional Name: [5-bromo-2-(4-chlorobenzyl)oxy-benzyl]-propyl-ammonium Formula: C17H20BrClNO+ MolecularWeight: 369.7038

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH2+]CC1=C(C=CC(=C1)Br)OCC2=CC=C(C=C2)Cl

Isomeric SMILES

CCC[NH2+]CC1=C(C=CC(=C1)Br)OCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H19BrClNO/c1-2-9-20-11-14-10-15(18)5-8-17(14)21-12-13-3-6-16(19)7-4-13/h3-8,10,20H,2,9,11-12H2,1H3/p+1