2-(7-azanyl-3-oxidanylidene-1,4-benzoxazin-4-yl)ethyl-dimethyl-azanium

Systemtic Name: 2-(7-azanyl-3-oxidanylidene-1,4-benzoxazin-4-yl)ethyl-dimethyl-azanium Openeye Name: 2-(7-amino-3-oxo-1,4-benzoxazin-4-yl)ethyl-dimethyl-ammonium CAS Name: 2-(7-amino-3-oxo-1,4-benzoxazin-4-yl)ethyl-dimethylammonium IUPAC Name: 2-(7-amino-3-oxo-1,4-benzoxazin-4-yl)ethyl-dimethylazanium Traditional Name: 2-(7-amino-3-keto-1,4-benzoxazin-4-yl)ethyl-dimethyl-ammonium Formula: C12H18N3O2+ MolecularWeight: 236.29022

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCN1C(=O)COC2=C1C=CC(=C2)N

Isomeric SMILES

C[NH+](C)CCN1C(=O)COC2=C1C=CC(=C2)N

InChI

InChI=1S/C12H17N3O2/c1-14(2)5-6-15-10-4-3-9(13)7-11(10)17-8-12(15)16/h3-4,7H,5-6,8,13H2,1-2H3/p+1