[3-bromanyl-4-[(3,4-dichlorophenyl)methoxy]-5-methoxy-phenyl]methyl-(pyridin-3-ylmethyl)azanium

Systemtic Name: [3-bromanyl-4-[(3,4-dichlorophenyl)methoxy]-5-methoxy-phenyl]methyl-(pyridin-3-ylmethyl)azanium Openeye Name: [3-bromo-4-[(3,4-dichlorophenyl)methoxy]-5-methoxy-phenyl]methyl-(3-pyridylmethyl)ammonium CAS Name: [3-bromo-4-[(3,4-dichlorophenyl)methoxy]-5-methoxyphenyl]methyl-(3-pyridinylmethyl)ammonium IUPAC Name: [3-bromo-4-[(3,4-dichlorophenyl)methoxy]-5-methoxyphenyl]methyl-(pyridin-3-ylmethyl)azanium Traditional Name: [3-bromo-4-(3,4-dichlorobenzyl)oxy-5-methoxy-benzyl]-(3-pyridylmethyl)ammonium Formula: C21H20BrCl2N2O2+ MolecularWeight: 483.2057

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C[NH2+]CC2=CN=CC=C2)Br)OCC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

COC1=C(C(=CC(=C1)C[NH2+]CC2=CN=CC=C2)Br)OCC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H19BrCl2N2O2/c1-27-20-9-16(12-26-11-15-3-2-6-25-10-15)7-17(22)21(20)28-13-14-4-5-18(23)19(24)8-14/h2-10,26H,11-13H2,1H3/p+1