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

Systemtic Name: [3-bromanyl-4-[(4-chlorophenyl)methoxy]-5-methoxy-phenyl]methyl-(2-hydroxyethyl)azanium Openeye Name: [3-bromo-4-[(4-chlorophenyl)methoxy]-5-methoxy-phenyl]methyl-(2-hydroxyethyl)ammonium CAS Name: [3-bromo-4-[(4-chlorophenyl)methoxy]-5-methoxyphenyl]methyl-(2-hydroxyethyl)ammonium IUPAC Name: [3-bromo-4-[(4-chlorophenyl)methoxy]-5-methoxyphenyl]methyl-(2-hydroxyethyl)azanium Traditional Name: [3-bromo-4-(4-chlorobenzyl)oxy-5-methoxy-benzyl]-(2-hydroxyethyl)ammonium Formula: C17H20BrClNO3+ MolecularWeight: 401.7026

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C[NH2+]CCO)Br)OCC2=CC=C(C=C2)Cl

Isomeric SMILES

COC1=C(C(=CC(=C1)C[NH2+]CCO)Br)OCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H19BrClNO3/c1-22-16-9-13(10-20-6-7-21)8-15(18)17(16)23-11-12-2-4-14(19)5-3-12/h2-5,8-9,20-21H,6-7,10-11H2,1H3/p+1