2-[(E)-but-1-enyl]-3-methyl-butanedioic acid

Systemtic Name: 2-[(E)-but-1-enyl]-3-methyl-butanedioic acid Openeye Name: 2-[(E)-but-1-enyl]-3-methyl-butanedioic acid CAS Name: 2-[(E)-but-1-enyl]-3-methylbutanedioic acid IUPAC Name: 2-[(E)-but-1-enyl]-3-methylbutanedioic acid Traditional Name: 2-[(E)-but-1-enyl]-3-methyl-succinic acid Formula: C9H14O4 MolecularWeight: 186.20506

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H14O4/c1-3-4-5-7(9(12)13)6(2)8(10)11/h4-7H,3H2,1-2H3,(H,10,11)(H,12,13)/b5-4+