(5-bromanyl-2-methoxy-phenyl)methyl-methyl-[2-oxidanylidene-2-[(2,4,6-trimethylphenyl)amino]ethyl]azanium

Systemtic Name: (5-bromanyl-2-methoxy-phenyl)methyl-methyl-[2-oxidanylidene-2-[(2,4,6-trimethylphenyl)amino]ethyl]azanium Openeye Name: (5-bromo-2-methoxy-phenyl)methyl-methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]ammonium CAS Name: (5-bromo-2-methoxyphenyl)methyl-methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]ammonium IUPAC Name: (5-bromo-2-methoxyphenyl)methyl-methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]azanium Traditional Name: (5-bromo-2-methoxy-benzyl)-(2-keto-2-mesidino-ethyl)-methyl-ammonium Formula: C20H26BrN2O2+ MolecularWeight: 406.33664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)C[NH+](C)CC2=C(C=CC(=C2)Br)OC)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)C[NH+](C)CC2=C(C=CC(=C2)Br)OC)C

InChI

InChI=1S/C20H25BrN2O2/c1-13-8-14(2)20(15(3)9-13)22-19(24)12-23(4)11-16-10-17(21)6-7-18(16)25-5/h6-10H,11-12H2,1-5H3,(H,22,24)/p+1