4-[(E)-[[2-oxidanylidene-2-(pyridin-3-ylmethylamino)ethanoyl]hydrazinylidene]methyl]benzoic acid

Systemtic Name: 4-[(E)-[[2-oxidanylidene-2-(pyridin-3-ylmethylamino)ethanoyl]hydrazinylidene]methyl]benzoic acid Openeye Name: 4-[(E)-[[2-oxo-2-(3-pyridylmethylamino)acetyl]hydrazono]methyl]benzoic acid CAS Name: 4-[(E)-[[1,2-dioxo-2-(3-pyridinylmethylamino)ethyl]hydrazinylidene]methyl]benzoic acid IUPAC Name: 4-[(E)-[[2-oxo-2-(pyridin-3-ylmethylamino)acetyl]hydrazinylidene]methyl]benzoic acid Traditional Name: 4-[(E)-[[2-keto-2-(3-pyridylmethylamino)acetyl]hydrazono]methyl]benzoic acid Formula: C16H14N4O4 MolecularWeight: 326.30676

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CNC(=O)C(=O)NN=CC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

C1=CC(=CN=C1)CNC(=O)C(=O)N/N=C/C2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C16H14N4O4/c21-14(18-9-12-2-1-7-17-8-12)15(22)20-19-10-11-3-5-13(6-4-11)16(23)24/h1-8,10H,9H2,(H,18,21)(H,20,22)(H,23,24)/b19-10+