(2E)-4-(2-ethylhexoxycarbonyl)penta-2,4-dienoic acid

Systemtic Name: (2E)-4-(2-ethylhexoxycarbonyl)penta-2,4-dienoic acid Openeye Name: (2E)-4-(2-ethylhexoxycarbonyl)penta-2,4-dienoic acid CAS Name: (2E)-4-[2-ethylhexoxy(oxo)methyl]penta-2,4-dienoic acid IUPAC Name: (2E)-4-(2-ethylhexoxycarbonyl)penta-2,4-dienoic acid Traditional Name: (2E)-4-(2-ethylhexoxycarbonyl)penta-2,4-dienoic acid Formula: C14H22O4 MolecularWeight: 254.32208

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC(=O)C(=C)C=CC(=O)O

Isomeric SMILES

CCCCC(CC)COC(=O)C(=C)/C=C/C(=O)O

InChI

InChI=1S/C14H22O4/c1-4-6-7-12(5-2)10-18-14(17)11(3)8-9-13(15)16/h8-9,12H,3-7,10H2,1-2H3,(H,15,16)/b9-8+