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

Systemtic Name: [3-bromanyl-4-[(4-chlorophenyl)methoxy]-5-ethoxy-phenyl]methyl-(2-methylpropyl)azanium Openeye Name: [3-bromo-4-[(4-chlorophenyl)methoxy]-5-ethoxy-phenyl]methyl-isobutyl-ammonium CAS Name: [3-bromo-4-[(4-chlorophenyl)methoxy]-5-ethoxyphenyl]methyl-(2-methylpropyl)ammonium IUPAC Name: [3-bromo-4-[(4-chlorophenyl)methoxy]-5-ethoxyphenyl]methyl-(2-methylpropyl)azanium Traditional Name: [3-bromo-4-(4-chlorobenzyl)oxy-5-ethoxy-benzyl]-isobutyl-ammonium Formula: C20H26BrClNO2+ MolecularWeight: 427.78294

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C[NH2+]CC(C)C)Br)OCC2=CC=C(C=C2)Cl

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C[NH2+]CC(C)C)Br)OCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C20H25BrClNO2/c1-4-24-19-10-16(12-23-11-14(2)3)9-18(21)20(19)25-13-15-5-7-17(22)8-6-15/h5-10,14,23H,4,11-13H2,1-3H3/p+1