2-[(3S)-7-bromanyl-3-methyl-2-oxidanylidene-pyrido[2,3-b][1,4]oxazin-1-yl]ethyl-dimethyl-azanium

Systemtic Name: 2-[(3S)-7-bromanyl-3-methyl-2-oxidanylidene-pyrido[2,3-b][1,4]oxazin-1-yl]ethyl-dimethyl-azanium Openeye Name: 2-[(3S)-7-bromo-3-methyl-2-oxo-pyrido[2,3-b][1,4]oxazin-1-yl]ethyl-dimethyl-ammonium CAS Name: 2-[(3S)-7-bromo-3-methyl-2-oxo-1-pyrido[2,3-b][1,4]oxazinyl]ethyl-dimethylammonium IUPAC Name: 2-[(3S)-7-bromo-3-methyl-2-oxopyrido[2,3-b][1,4]oxazin-1-yl]ethyl-dimethylazanium Traditional Name: 2-[(3S)-7-bromo-2-keto-3-methyl-pyrido[2,3-b][1,4]oxazin-1-yl]ethyl-dimethyl-ammonium Formula: C12H17BrN3O2+ MolecularWeight: 315.18628

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C2=CC(=CN=C2O1)Br)CC[NH+](C)C

Isomeric SMILES

C[C@H]1C(=O)N(C2=CC(=CN=C2O1)Br)CC[NH+](C)C

InChI

InChI=1S/C12H16BrN3O2/c1-8-12(17)16(5-4-15(2)3)10-6-9(13)7-14-11(10)18-8/h6-8H,4-5H2,1-3H3/p+1/t8-/m0/s1