2-[3-(oxan-2-yloxy)butyl]-3-oxidanylidene-4-[(E)-pent-2-enyl]pentanedioic acid

Systemtic Name: 2-[3-(oxan-2-yloxy)butyl]-3-oxidanylidene-4-[(E)-pent-2-enyl]pentanedioic acid Openeye Name: 3-oxo-2-[(E)-pent-2-enyl]-4-(3-tetrahydropyran-2-yloxybutyl)pentanedioic acid CAS Name: 2-[3-(2-oxanyloxy)butyl]-3-oxo-4-[(E)-pent-2-enyl]pentanedioic acid IUPAC Name: 2-[3-(oxan-2-yloxy)butyl]-3-oxo-4-[(E)-pent-2-enyl]pentanedioic acid Traditional Name: 3-keto-2-[(E)-pent-2-enyl]-4-(3-tetrahydropyran-2-yloxybutyl)glutaric acid Formula: C19H30O7 MolecularWeight: 370.4373

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Descriptors Computed from Structure

Canonical SMILES:

CCC=CCC(C(=O)C(CCC(C)OC1CCCCO1)C(=O)O)C(=O)O

Isomeric SMILES

CC/C=C/CC(C(=O)C(CCC(C)OC1CCCCO1)C(=O)O)C(=O)O

InChI

InChI=1S/C19H30O7/c1-3-4-5-8-14(18(21)22)17(20)15(19(23)24)11-10-13(2)26-16-9-6-7-12-25-16/h4-5,13-16H,3,6-12H2,1-2H3,(H,21,22)(H,23,24)/b5-4+