2-[3-(carboxymethyl)-5-methyl-5-nitro-1,3-diazinan-1-yl]ethanoic acid

Systemtic Name: 2-[3-(carboxymethyl)-5-methyl-5-nitro-1,3-diazinan-1-yl]ethanoic acid Openeye Name: 2-[3-(carboxymethyl)-5-methyl-5-nitro-hexahydropyrimidin-1-yl]acetic acid CAS Name: 2-[3-(carboxymethyl)-5-methyl-5-nitro-1,3-diazinan-1-yl]acetic acid IUPAC Name: 2-[3-(carboxymethyl)-5-methyl-5-nitro-1,3-diazinan-1-yl]acetic acid Traditional Name: 2-[3-(carboxymethyl)-5-methyl-5-nitro-hexahydropyrimidin-1-yl]acetic acid Formula: C9H15N3O6 MolecularWeight: 261.2319

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(CN(C1)CC(=O)O)CC(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC1(CN(CN(C1)CC(=O)O)CC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C9H15N3O6/c1-9(12(17)18)4-10(2-7(13)14)6-11(5-9)3-8(15)16/h2-6H2,1H3,(H,13,14)(H,15,16)