[5-bromanyl-2-[(2S)-1-(2-methoxyethylamino)-1-oxidanylidene-propan-2-yl]oxy-phenyl]methylazanium

Systemtic Name: [5-bromanyl-2-[(2S)-1-(2-methoxyethylamino)-1-oxidanylidene-propan-2-yl]oxy-phenyl]methylazanium Openeye Name: [5-bromo-2-[(1S)-2-(2-methoxyethylamino)-1-methyl-2-oxo-ethoxy]phenyl]methylammonium CAS Name: [5-bromo-2-[(2S)-1-(2-methoxyethylamino)-1-oxopropan-2-yl]oxyphenyl]methylammonium IUPAC Name: [5-bromo-2-[(2S)-1-(2-methoxyethylamino)-1-oxopropan-2-yl]oxyphenyl]methylazanium Traditional Name: [5-bromo-2-[(1S)-2-keto-2-(2-methoxyethylamino)-1-methyl-ethoxy]benzyl]ammonium Formula: C13H20BrN2O3+ MolecularWeight: 332.2135

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCOC)OC1=C(C=C(C=C1)Br)C[NH3+]

Isomeric SMILES

C[C@@H](C(=O)NCCOC)OC1=C(C=C(C=C1)Br)C[NH3+]

InChI

InChI=1S/C13H19BrN2O3/c1-9(13(17)16-5-6-18-2)19-12-4-3-11(14)7-10(12)8-15/h3-4,7,9H,5-6,8,15H2,1-2H3,(H,16,17)/p+1/t9-/m0/s1