[3-bromanyl-4-[(2,4-dichlorophenyl)methoxy]-5-ethoxy-phenyl]methyl-phenethyl-azanium

Systemtic Name: [3-bromanyl-4-[(2,4-dichlorophenyl)methoxy]-5-ethoxy-phenyl]methyl-phenethyl-azanium Openeye Name: [3-bromo-4-[(2,4-dichlorophenyl)methoxy]-5-ethoxy-phenyl]methyl-phenethyl-ammonium CAS Name: [3-bromo-4-[(2,4-dichlorophenyl)methoxy]-5-ethoxyphenyl]methyl-phenethylammonium IUPAC Name: [3-bromo-4-[(2,4-dichlorophenyl)methoxy]-5-ethoxyphenyl]methyl-phenethylazanium Traditional Name: [3-bromo-4-(2,4-dichlorobenzyl)oxy-5-ethoxy-benzyl]-phenethyl-ammonium Formula: C24H25BrCl2NO2+ MolecularWeight: 510.2708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C[NH2+]CCC2=CC=CC=C2)Br)OCC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C[NH2+]CCC2=CC=CC=C2)Br)OCC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C24H24BrCl2NO2/c1-2-29-23-13-18(15-28-11-10-17-6-4-3-5-7-17)12-21(25)24(23)30-16-19-8-9-20(26)14-22(19)27/h3-9,12-14,28H,2,10-11,15-16H2,1H3/p+1