2-[[4-ethoxy-6-[(2-oxidanidyl-2-oxidanylidene-ethyl)amino]-1,3,5-triazin-2-yl]azaniumyl]ethanoate

Systemtic Name: 2-[[4-ethoxy-6-[(2-oxidanidyl-2-oxidanylidene-ethyl)amino]-1,3,5-triazin-2-yl]azaniumyl]ethanoate Openeye Name: 2-[[4-ethoxy-6-[(2-oxido-2-oxo-ethyl)amino]-1,3,5-triazin-2-yl]ammonio]acetate CAS Name: 2-[[4-ethoxy-6-[(2-oxido-2-oxoethyl)amino]-1,3,5-triazin-2-yl]ammonio]acetate IUPAC Name: 2-[[4-ethoxy-6-[(2-oxido-2-oxoethyl)amino]-1,3,5-triazin-2-yl]azaniumyl]acetate Traditional Name: 2-[[4-ethoxy-6-[(2-keto-2-oxido-ethyl)amino]-s-triazin-2-yl]ammonio]acetate Formula: C9H12N5O5- MolecularWeight: 270.22208

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC(=NC(=N1)[NH2+]CC(=O)[O-])NCC(=O)[O-]

Isomeric SMILES

CCOC1=NC(=NC(=N1)[NH2+]CC(=O)[O-])NCC(=O)[O-]

InChI

InChI=1S/C9H13N5O5/c1-2-19-9-13-7(10-3-5(15)16)12-8(14-9)11-4-6(17)18/h2-4H2,1H3,(H,15,16)(H,17,18)(H2,10,11,12,13,14)/p-1