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

Systemtic Name: [3-bromanyl-4-[(3,4-dichlorophenyl)methoxy]-5-methoxy-phenyl]methyl-(2-methoxyethyl)azanium Openeye Name: [3-bromo-4-[(3,4-dichlorophenyl)methoxy]-5-methoxy-phenyl]methyl-(2-methoxyethyl)ammonium CAS Name: [3-bromo-4-[(3,4-dichlorophenyl)methoxy]-5-methoxyphenyl]methyl-(2-methoxyethyl)ammonium IUPAC Name: [3-bromo-4-[(3,4-dichlorophenyl)methoxy]-5-methoxyphenyl]methyl-(2-methoxyethyl)azanium Traditional Name: [3-bromo-4-(3,4-dichlorobenzyl)oxy-5-methoxy-benzyl]-(2-methoxyethyl)ammonium Formula: C18H21BrCl2NO3+ MolecularWeight: 450.17424

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Descriptors Computed from Structure

Canonical SMILES:

COCC[NH2+]CC1=CC(=C(C(=C1)Br)OCC2=CC(=C(C=C2)Cl)Cl)OC

Isomeric SMILES

COCC[NH2+]CC1=CC(=C(C(=C1)Br)OCC2=CC(=C(C=C2)Cl)Cl)OC

InChI

InChI=1S/C18H20BrCl2NO3/c1-23-6-5-22-10-13-7-14(19)18(17(9-13)24-2)25-11-12-3-4-15(20)16(21)8-12/h3-4,7-9,22H,5-6,10-11H2,1-2H3/p+1