4-[(E)-[[2-oxidanylidene-2-(propan-2-ylamino)ethanoyl]hydrazinylidene]methyl]benzoic acid

Systemtic Name: 4-[(E)-[[2-oxidanylidene-2-(propan-2-ylamino)ethanoyl]hydrazinylidene]methyl]benzoic acid Openeye Name: 4-[(E)-[[2-(isopropylamino)-2-oxo-acetyl]hydrazono]methyl]benzoic acid CAS Name: 4-[(E)-[[1,2-dioxo-2-(propan-2-ylamino)ethyl]hydrazinylidene]methyl]benzoic acid IUPAC Name: 4-[(E)-[[2-oxo-2-(propan-2-ylamino)acetyl]hydrazinylidene]methyl]benzoic acid Traditional Name: 4-[(E)-[[2-(isopropylamino)-2-keto-acetyl]hydrazono]methyl]benzoic acid Formula: C13H15N3O4 MolecularWeight: 277.2759

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C(=O)NN=CC1=CC=C(C=C1)C(=O)O

Isomeric SMILES

CC(C)NC(=O)C(=O)N/N=C/C1=CC=C(C=C1)C(=O)O

InChI

InChI=1S/C13H15N3O4/c1-8(2)15-11(17)12(18)16-14-7-9-3-5-10(6-4-9)13(19)20/h3-8H,1-2H3,(H,15,17)(H,16,18)(H,19,20)/b14-7+