2-[[2-(4-ethyl-3-oxidanylidene-1,4-benzoxazin-6-yl)-2-oxidanylidene-ethyl]-methyl-azaniumyl]ethanoate

Systemtic Name: 2-[[2-(4-ethyl-3-oxidanylidene-1,4-benzoxazin-6-yl)-2-oxidanylidene-ethyl]-methyl-azaniumyl]ethanoate Openeye Name: 2-[[2-(4-ethyl-3-oxo-1,4-benzoxazin-6-yl)-2-oxo-ethyl]-methyl-ammonio]acetate CAS Name: 2-[[2-(4-ethyl-3-oxo-1,4-benzoxazin-6-yl)-2-oxoethyl]-methylammonio]acetate IUPAC Name: 2-[[2-(4-ethyl-3-oxo-1,4-benzoxazin-6-yl)-2-oxoethyl]-methylazaniumyl]acetate Traditional Name: 2-[[2-(4-ethyl-3-keto-1,4-benzoxazin-6-yl)-2-keto-ethyl]-methyl-ammonio]acetate Formula: C15H18N2O5 MolecularWeight: 306.31382

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18N2O5/c1-3-17-11-6-10(4-5-13(11)22-9-14(17)19)12(18)7-16(2)8-15(20)21/h4-6H,3,7-9H2,1-2H3,(H,20,21)