[3-bromanyl-4-[(2-chlorophenyl)methoxy]-5-ethoxy-phenyl]methyl-pentyl-azanium

Systemtic Name: [3-bromanyl-4-[(2-chlorophenyl)methoxy]-5-ethoxy-phenyl]methyl-pentyl-azanium Openeye Name: [3-bromo-4-[(2-chlorophenyl)methoxy]-5-ethoxy-phenyl]methyl-pentyl-ammonium CAS Name: [3-bromo-4-[(2-chlorophenyl)methoxy]-5-ethoxyphenyl]methyl-pentylammonium IUPAC Name: [3-bromo-4-[(2-chlorophenyl)methoxy]-5-ethoxyphenyl]methyl-pentylazanium Traditional Name: amyl-[3-bromo-4-(2-chlorobenzyl)oxy-5-ethoxy-benzyl]ammonium Formula: C21H28BrClNO2+ MolecularWeight: 441.80952

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC[NH2+]CC1=CC(=C(C(=C1)Br)OCC2=CC=CC=C2Cl)OCC

Isomeric SMILES

CCCCC[NH2+]CC1=CC(=C(C(=C1)Br)OCC2=CC=CC=C2Cl)OCC

InChI

InChI=1S/C21H27BrClNO2/c1-3-5-8-11-24-14-16-12-18(22)21(20(13-16)25-4-2)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/p+1