(E,7E)-7-(3-bromanyl-5-butyl-2-oxidanylidene-cyclopent-3-en-1-ylidene)hept-5-enoic acid

Systemtic Name: (E,7E)-7-(3-bromanyl-5-butyl-2-oxidanylidene-cyclopent-3-en-1-ylidene)hept-5-enoic acid Openeye Name: (E,7E)-7-(3-bromo-5-butyl-2-oxo-cyclopent-3-en-1-ylidene)hept-5-enoic acid CAS Name: (E,7E)-7-(3-bromo-5-butyl-2-oxo-1-cyclopent-3-enylidene)-5-heptenoic acid IUPAC Name: (E,7E)-7-(3-bromo-5-butyl-2-oxocyclopent-3-en-1-ylidene)hept-5-enoic acid Traditional Name: (E,7E)-7-(3-bromo-5-butyl-2-keto-cyclopent-3-en-1-ylidene)hept-5-enoic acid Formula: C16H21BrO3 MolecularWeight: 341.24014

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C=C(C(=O)C1=CC=CCCCC(=O)O)Br

Isomeric SMILES

CCCCC\1C=C(C(=O)/C1=C/C=C/CCCC(=O)O)Br

InChI

InChI=1S/C16H21BrO3/c1-2-3-8-12-11-14(17)16(20)13(12)9-6-4-5-7-10-15(18)19/h4,6,9,11-12H,2-3,5,7-8,10H2,1H3,(H,18,19)/b6-4+,13-9+