2-(7-azanyl-2,2-dimethyl-3,4-dihydro-1,4-benzoxazin-4-ium-4-yl)ethanoate

Systemtic Name: 2-(7-azanyl-2,2-dimethyl-3,4-dihydro-1,4-benzoxazin-4-ium-4-yl)ethanoate Openeye Name: 2-(7-amino-2,2-dimethyl-3,4-dihydro-1,4-benzoxazin-4-ium-4-yl)acetate CAS Name: 2-(7-amino-2,2-dimethyl-3,4-dihydro-1,4-benzoxazin-4-ium-4-yl)acetate IUPAC Name: 2-(7-amino-2,2-dimethyl-3,4-dihydro-1,4-benzoxazin-4-ium-4-yl)acetate Traditional Name: 2-(7-amino-2,2-dimethyl-3,4-dihydro-1,4-benzoxazin-4-ium-4-yl)acetate Formula: C12H16N2O3 MolecularWeight: 236.26704

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C[NH+](C2=C(O1)C=C(C=C2)N)CC(=O)[O-])C

Isomeric SMILES

CC1(C[NH+](C2=C(O1)C=C(C=C2)N)CC(=O)[O-])C

InChI

InChI=1S/C12H16N2O3/c1-12(2)7-14(6-11(15)16)9-4-3-8(13)5-10(9)17-12/h3-5H,6-7,13H2,1-2H3,(H,15,16)