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

Systemtic Name: [3-bromanyl-4-[(4-chlorophenyl)methoxy]-5-ethoxy-phenyl]methyl-(3-methoxypropyl)azanium Openeye Name: [3-bromo-4-[(4-chlorophenyl)methoxy]-5-ethoxy-phenyl]methyl-(3-methoxypropyl)ammonium CAS Name: [3-bromo-4-[(4-chlorophenyl)methoxy]-5-ethoxyphenyl]methyl-(3-methoxypropyl)ammonium IUPAC Name: [3-bromo-4-[(4-chlorophenyl)methoxy]-5-ethoxyphenyl]methyl-(3-methoxypropyl)azanium Traditional Name: [3-bromo-4-(4-chlorobenzyl)oxy-5-ethoxy-benzyl]-(3-methoxypropyl)ammonium Formula: C20H26BrClNO3+ MolecularWeight: 443.78234

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25BrClNO3/c1-3-25-19-12-16(13-23-9-4-10-24-2)11-18(21)20(19)26-14-15-5-7-17(22)8-6-15/h5-8,11-12,23H,3-4,9-10,13-14H2,1-2H3/p+1