3-(6-chloranyl-2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)propyl-methyl-azanium; 2-oxidanyl-2-oxidanylidene-ethanoate

Systemtic Name: 3-(6-chloranyl-2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)propyl-methyl-azanium; 2-oxidanyl-2-oxidanylidene-ethanoate Openeye Name: 3-(6-chloro-2-methyl-3-oxo-1,4-benzoxazin-4-yl)propyl-methyl-ammonium; 2-hydroxy-2-oxo-acetate CAS Name: 3-(6-chloro-2-methyl-3-oxo-1,4-benzoxazin-4-yl)propyl-methylammonium; 2-hydroxy-2-oxoacetate IUPAC Name: 3-(6-chloro-2-methyl-3-oxo-1,4-benzoxazin-4-yl)propyl-methylazanium; 2-hydroxy-2-oxoacetate Traditional Name: 3-(6-chloro-3-keto-2-methyl-1,4-benzoxazin-4-yl)propyl-methyl-ammonium binoxalate Formula: C15H19ClN2O6 MolecularWeight: 358.77416

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C2=C(O1)C=CC(=C2)Cl)CCC[NH2+]C.C(=O)(C(=O)[O-])O

Isomeric SMILES

CC1C(=O)N(C2=C(O1)C=CC(=C2)Cl)CCC[NH2+]C.C(=O)(C(=O)[O-])O

InChI

InChI=1S/C13H17ClN2O2.C2H2O4/c1-9-13(17)16(7-3-6-15-2)11-8-10(14)4-5-12(11)18-9;3-1(4)2(5)6/h4-5,8-9,15H,3,6-7H2,1-2H3;(H,3,4)(H,5,6)