6-azanylidene-7,7-dimethyl-5-(1-oxidanyl-1-oxidanylidene-propan-2-yl)-3,4-dihydro-1,2,5-triazepine-4-carboxylic acid

Systemtic Name: 6-azanylidene-7,7-dimethyl-5-(1-oxidanyl-1-oxidanylidene-propan-2-yl)-3,4-dihydro-1,2,5-triazepine-4-carboxylic acid Openeye Name: 5-(2-hydroxy-1-methyl-2-oxo-ethyl)-6-imino-7,7-dimethyl-3,4-dihydro-1,2,5-triazepine-4-carboxylic acid CAS Name: 5-(1-hydroxy-1-oxopropan-2-yl)-6-imino-7,7-dimethyl-3,4-dihydro-1,2,5-triazepine-4-carboxylic acid IUPAC Name: 5-(1-hydroxy-1-oxopropan-2-yl)-6-imino-7,7-dimethyl-3,4-dihydro-1,2,5-triazepine-4-carboxylic acid Traditional Name: 5-(2-hydroxy-2-keto-1-methyl-ethyl)-6-imino-7,7-dimethyl-3,4-dihydro-1,2,5-triazepine-4-carboxylic acid Formula: C10H16N4O4 MolecularWeight: 256.25844

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)N1C(CN=NC(C1=N)(C)C)C(=O)O

Isomeric SMILES

CC(C(=O)O)N1C(CN=NC(C1=N)(C)C)C(=O)O

InChI

InChI=1S/C10H16N4O4/c1-5(7(15)16)14-6(8(17)18)4-12-13-10(2,3)9(14)11/h5-6,11H,4H2,1-3H3,(H,15,16)(H,17,18)