4-[[[(2E,4E)-hexa-2,4-dienoyl]amino]methyl]benzoic acid

Systemtic Name: 4-[[[(2E,4E)-hexa-2,4-dienoyl]amino]methyl]benzoic acid Openeye Name: 4-[[[(2E,4E)-hexa-2,4-dienoyl]amino]methyl]benzoic acid CAS Name: 4-[[[(2E,4E)-1-oxohexa-2,4-dienyl]amino]methyl]benzoic acid IUPAC Name: 4-[[[(2E,4E)-hexa-2,4-dienoyl]amino]methyl]benzoic acid Traditional Name: 4-[[[(2E,4E)-hexa-2,4-dienoyl]amino]methyl]benzoic acid Formula: C14H15NO3 MolecularWeight: 245.2738

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC=CC(=O)NCC1=CC=C(C=C1)C(=O)O

Isomeric SMILES

C/C=C/C=C/C(=O)NCC1=CC=C(C=C1)C(=O)O

InChI

InChI=1S/C14H15NO3/c1-2-3-4-5-13(16)15-10-11-6-8-12(9-7-11)14(17)18/h2-9H,10H2,1H3,(H,15,16)(H,17,18)/b3-2+,5-4+