(5-bromanyl-2-methoxy-phenyl)methyl-[2-[2-(4-methoxyphenyl)ethylamino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: (5-bromanyl-2-methoxy-phenyl)methyl-[2-[2-(4-methoxyphenyl)ethylamino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: (5-bromo-2-methoxy-phenyl)methyl-[2-[2-(4-methoxyphenyl)ethylamino]-2-oxo-ethyl]-methyl-ammonium CAS Name: (5-bromo-2-methoxyphenyl)methyl-[2-[2-(4-methoxyphenyl)ethylamino]-2-oxoethyl]-methylammonium IUPAC Name: (5-bromo-2-methoxyphenyl)methyl-[2-[2-(4-methoxyphenyl)ethylamino]-2-oxoethyl]-methylazanium Traditional Name: (5-bromo-2-methoxy-benzyl)-[2-keto-2-[2-(4-methoxyphenyl)ethylamino]ethyl]-methyl-ammonium Formula: C20H26BrN2O3+ MolecularWeight: 422.33604

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=C(C=CC(=C1)Br)OC)CC(=O)NCCC2=CC=C(C=C2)OC

Isomeric SMILES

C[NH+](CC1=C(C=CC(=C1)Br)OC)CC(=O)NCCC2=CC=C(C=C2)OC

InChI

InChI=1S/C20H25BrN2O3/c1-23(13-16-12-17(21)6-9-19(16)26-3)14-20(24)22-11-10-15-4-7-18(25-2)8-5-15/h4-9,12H,10-11,13-14H2,1-3H3,(H,22,24)/p+1