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

Systemtic Name: [3-bromanyl-4-[(3,4-dichlorophenyl)methoxy]-5-methoxy-phenyl]methyl-(furan-2-ylmethyl)azanium Openeye Name: [3-bromo-4-[(3,4-dichlorophenyl)methoxy]-5-methoxy-phenyl]methyl-(2-furylmethyl)ammonium CAS Name: [3-bromo-4-[(3,4-dichlorophenyl)methoxy]-5-methoxyphenyl]methyl-(2-furanylmethyl)ammonium IUPAC Name: [3-bromo-4-[(3,4-dichlorophenyl)methoxy]-5-methoxyphenyl]methyl-(furan-2-ylmethyl)azanium Traditional Name: [3-bromo-4-(3,4-dichlorobenzyl)oxy-5-methoxy-benzyl]-(2-furfuryl)ammonium Formula: C20H19BrCl2NO3+ MolecularWeight: 472.17976

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C[NH2+]CC2=CC=CO2)Br)OCC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

COC1=C(C(=CC(=C1)C[NH2+]CC2=CC=CO2)Br)OCC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C20H18BrCl2NO3/c1-25-19-9-14(10-24-11-15-3-2-6-26-15)7-16(21)20(19)27-12-13-4-5-17(22)18(23)8-13/h2-9,24H,10-12H2,1H3/p+1