4-methyl-3-[(4-oxidanidyl-4-oxidanylidene-butanoyl)amino]benzoate

Systemtic Name: 4-methyl-3-[(4-oxidanidyl-4-oxidanylidene-butanoyl)amino]benzoate Openeye Name: 4-methyl-3-[(4-oxido-4-oxo-butanoyl)amino]benzoate CAS Name: 4-methyl-3-[(4-oxido-1,4-dioxobutyl)amino]benzoate IUPAC Name: 4-methyl-3-[(4-oxido-4-oxobutanoyl)amino]benzoate Traditional Name: 3-[(4-keto-4-oxido-butanoyl)amino]-4-methyl-benzoate Formula: C12H11NO5-2 MolecularWeight: 249.21944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)[O-])NC(=O)CCC(=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)[O-])NC(=O)CCC(=O)[O-]

InChI

InChI=1S/C12H13NO5/c1-7-2-3-8(12(17)18)6-9(7)13-10(14)4-5-11(15)16/h2-3,6H,4-5H2,1H3,(H,13,14)(H,15,16)(H,17,18)/p-2