2-[(E)-but-1-enyl]-2-butyl-butanedioic acid

Systemtic Name: 2-[(E)-but-1-enyl]-2-butyl-butanedioic acid Openeye Name: 2-[(E)-but-1-enyl]-2-butyl-butanedioic acid CAS Name: 2-[(E)-but-1-enyl]-2-butylbutanedioic acid IUPAC Name: 2-[(E)-but-1-enyl]-2-butylbutanedioic acid Traditional Name: 2-[(E)-but-1-enyl]-2-butyl-succinic acid Formula: C12H20O4 MolecularWeight: 228.2848

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC(=O)O)(C=CCC)C(=O)O

Isomeric SMILES

CCCCC(CC(=O)O)(/C=C/CC)C(=O)O

InChI

InChI=1S/C12H20O4/c1-3-5-7-12(11(15)16,8-6-4-2)9-10(13)14/h5,7H,3-4,6,8-9H2,1-2H3,(H,13,14)(H,15,16)/b7-5+