4-methyl-7-[(1R,2S)-2-[(E)-non-1-enyl]-5-oxidanylidene-cyclopent-3-en-1-yl]-2-oxidanyl-hepta-4,5-dienoic acid

Systemtic Name: 4-methyl-7-[(1R,2S)-2-[(E)-non-1-enyl]-5-oxidanylidene-cyclopent-3-en-1-yl]-2-oxidanyl-hepta-4,5-dienoic acid Openeye Name: 2-hydroxy-4-methyl-7-[(1R,2S)-2-[(E)-non-1-enyl]-5-oxo-cyclopent-3-en-1-yl]hepta-4,5-dienoic acid CAS Name: 2-hydroxy-4-methyl-7-[(1R,2S)-2-[(E)-non-1-enyl]-5-oxo-1-cyclopent-3-enyl]hepta-4,5-dienoic acid IUPAC Name: 2-hydroxy-4-methyl-7-[(1R,2S)-2-[(E)-non-1-enyl]-5-oxocyclopent-3-en-1-yl]hepta-4,5-dienoic acid Traditional Name: 2-hydroxy-7-[(1R,5S)-2-keto-5-[(E)-non-1-enyl]cyclopent-3-en-1-yl]-4-methyl-hepta-4,5-dienoic acid Formula: C22H32O4 MolecularWeight: 360.48708

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC=CC1C=CC(=O)C1CC=C=C(C)CC(C(=O)O)O

Isomeric SMILES

CCCCCCC/C=C/[C@H]1C=CC(=O)[C@@H]1CC=C=C(C)CC(C(=O)O)O

InChI

InChI=1S/C22H32O4/c1-3-4-5-6-7-8-9-12-18-14-15-20(23)19(18)13-10-11-17(2)16-21(24)22(25)26/h9-10,12,14-15,18-19,21,24H,3-8,13,16H2,1-2H3,(H,25,26)/b12-9+/t11?,18-,19+,21?/m0/s1