(2Z,4E)-5-(2,3-dihydro-1-benzoxepin-4-yl)-3-methyl-penta-2,4-dienoic acid

Systemtic Name: (2Z,4E)-5-(2,3-dihydro-1-benzoxepin-4-yl)-3-methyl-penta-2,4-dienoic acid Openeye Name: (2Z,4E)-5-(2,3-dihydro-1-benzoxepin-4-yl)-3-methyl-penta-2,4-dienoic acid CAS Name: (2Z,4E)-5-(2,3-dihydro-1-benzoxepin-4-yl)-3-methylpenta-2,4-dienoic acid IUPAC Name: (2Z,4E)-5-(2,3-dihydro-1-benzoxepin-4-yl)-3-methylpenta-2,4-dienoic acid Traditional Name: (2Z,4E)-5-(2,3-dihydro-1-benzoxepin-4-yl)-3-methyl-penta-2,4-dienoic acid Formula: C16H16O3 MolecularWeight: 256.29644

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)O)C=CC1=CC2=CC=CC=C2OCC1

Isomeric SMILES

C/C(=C/C(=O)O)/C=C/C1=CC2=CC=CC=C2OCC1

InChI

InChI=1S/C16H16O3/c1-12(10-16(17)18)6-7-13-8-9-19-15-5-3-2-4-14(15)11-13/h2-7,10-11H,8-9H2,1H3,(H,17,18)/b7-6+,12-10-