2-[carboxymethyl-[(E)-2-nitroso-3-(oxidanylamino)but-2-enyl]amino]ethanoic acid

Systemtic Name: 2-[carboxymethyl-[(E)-2-nitroso-3-(oxidanylamino)but-2-enyl]amino]ethanoic acid Openeye Name: 2-[carboxymethyl-[(E)-3-(hydroxyamino)-2-nitroso-but-2-enyl]amino]acetic acid CAS Name: 2-[carboxymethyl-[(E)-3-(hydroxyamino)-2-nitrosobut-2-enyl]amino]acetic acid IUPAC Name: 2-[carboxymethyl-[(E)-3-(hydroxyamino)-2-nitrosobut-2-enyl]amino]acetic acid Traditional Name: 2-[carboxymethyl-[(E)-3-(hydroxyamino)-2-nitroso-but-2-enyl]amino]acetic acid Formula: C8H13N3O6 MolecularWeight: 247.20532

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(CN(CC(=O)O)CC(=O)O)N=O)NO

Isomeric SMILES

C/C(=C(/CN(CC(=O)O)CC(=O)O)\N=O)/NO

InChI

InChI=1S/C8H13N3O6/c1-5(9-16)6(10-17)2-11(3-7(12)13)4-8(14)15/h9,16H,2-4H2,1H3,(H,12,13)(H,14,15)/b6-5+