4-[(E)-(2-oxidanylidene-3-pentyl-cyclopent-3-en-1-ylidene)methyl]benzoic acid

Systemtic Name: 4-[(E)-(2-oxidanylidene-3-pentyl-cyclopent-3-en-1-ylidene)methyl]benzoic acid Openeye Name: 4-[(E)-(2-oxo-3-pentyl-cyclopent-3-en-1-ylidene)methyl]benzoic acid CAS Name: 4-[(E)-(2-oxo-3-pentyl-1-cyclopent-3-enylidene)methyl]benzoic acid IUPAC Name: 4-[(E)-(2-oxo-3-pentylcyclopent-3-en-1-ylidene)methyl]benzoic acid Traditional Name: 4-[(E)-(3-amyl-2-keto-cyclopent-3-en-1-ylidene)methyl]benzoic acid Formula: C18H20O3 MolecularWeight: 284.3496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CCC(=CC2=CC=C(C=C2)C(=O)O)C1=O

Isomeric SMILES

CCCCCC1=CC/C(=C\C2=CC=C(C=C2)C(=O)O)/C1=O

InChI

InChI=1S/C18H20O3/c1-2-3-4-5-14-10-11-16(17(14)19)12-13-6-8-15(9-7-13)18(20)21/h6-10,12H,2-5,11H2,1H3,(H,20,21)/b16-12+