5-[[(2E,4E)-hexa-2,4-dienoyl]amino]benzene-1,3-dicarboxylic acid

Systemtic Name: 5-[[(2E,4E)-hexa-2,4-dienoyl]amino]benzene-1,3-dicarboxylic acid Openeye Name: 5-[[(2E,4E)-hexa-2,4-dienoyl]amino]benzene-1,3-dicarboxylic acid CAS Name: 5-[[(2E,4E)-1-oxohexa-2,4-dienyl]amino]benzene-1,3-dicarboxylic acid IUPAC Name: 5-[[(2E,4E)-hexa-2,4-dienoyl]amino]benzene-1,3-dicarboxylic acid Traditional Name: 5-[[(2E,4E)-hexa-2,4-dienoyl]amino]isophthalic acid Formula: C14H13NO5 MolecularWeight: 275.25672

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC=CC(=O)NC1=CC(=CC(=C1)C(=O)O)C(=O)O

Isomeric SMILES

C/C=C/C=C/C(=O)NC1=CC(=CC(=C1)C(=O)O)C(=O)O

InChI

InChI=1S/C14H13NO5/c1-2-3-4-5-12(16)15-11-7-9(13(17)18)6-10(8-11)14(19)20/h2-8H,1H3,(H,15,16)(H,17,18)(H,19,20)/b3-2+,5-4+