(E)-7-[(1R)-2-[(E)-3-methyloct-1-enyl]-5-oxidanylidene-cyclopentyl]hept-5-enoic acid

Systemtic Name: (E)-7-[(1R)-2-[(E)-3-methyloct-1-enyl]-5-oxidanylidene-cyclopentyl]hept-5-enoic acid Openeye Name: (E)-7-[(1R)-2-[(E)-3-methyloct-1-enyl]-5-oxo-cyclopentyl]hept-5-enoic acid CAS Name: (E)-7-[(1R)-2-[(E)-3-methyloct-1-enyl]-5-oxocyclopentyl]-5-heptenoic acid IUPAC Name: (E)-7-[(1R)-2-[(E)-3-methyloct-1-enyl]-5-oxocyclopentyl]hept-5-enoic acid Traditional Name: (E)-7-[(1R)-2-keto-5-[(E)-3-methyloct-1-enyl]cyclopentyl]hept-5-enoic acid Formula: C21H34O3 MolecularWeight: 334.49286

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)C=CC1CCC(=O)C1CC=CCCCC(=O)O

Isomeric SMILES

CCCCCC(C)/C=C/C1CCC(=O)[C@@H]1C/C=C/CCCC(=O)O

InChI

InChI=1S/C21H34O3/c1-3-4-7-10-17(2)13-14-18-15-16-20(22)19(18)11-8-5-6-9-12-21(23)24/h5,8,13-14,17-19H,3-4,6-7,9-12,15-16H2,1-2H3,(H,23,24)/b8-5+,14-13+/t17?,18?,19-/m1/s1