4-[4-[[(2E,4E)-hexa-2,4-dienoyl]amino]phenoxy]phthalic acid

Systemtic Name: 4-[4-[[(2E,4E)-hexa-2,4-dienoyl]amino]phenoxy]phthalic acid Openeye Name: 4-[4-[[(2E,4E)-hexa-2,4-dienoyl]amino]phenoxy]phthalic acid CAS Name: 4-[4-[[(2E,4E)-1-oxohexa-2,4-dienyl]amino]phenoxy]phthalic acid IUPAC Name: 4-[4-[[(2E,4E)-hexa-2,4-dienoyl]amino]phenoxy]phthalic acid Traditional Name: 4-[4-[[(2E,4E)-hexa-2,4-dienoyl]amino]phenoxy]phthalic acid Formula: C20H17NO6 MolecularWeight: 367.35208

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC=CC(=O)NC1=CC=C(C=C1)OC2=CC(=C(C=C2)C(=O)O)C(=O)O

Isomeric SMILES

C/C=C/C=C/C(=O)NC1=CC=C(C=C1)OC2=CC(=C(C=C2)C(=O)O)C(=O)O

InChI

InChI=1S/C20H17NO6/c1-2-3-4-5-18(22)21-13-6-8-14(9-7-13)27-15-10-11-16(19(23)24)17(12-15)20(25)26/h2-12H,1H3,(H,21,22)(H,23,24)(H,25,26)/b3-2+,5-4+