(E)-5-ethoxy-2-ethyl-3-oxidanylidene-pent-4-enoic acid

Systemtic Name: (E)-5-ethoxy-2-ethyl-3-oxidanylidene-pent-4-enoic acid Openeye Name: (E)-5-ethoxy-2-ethyl-3-oxo-pent-4-enoic acid CAS Name: (E)-5-ethoxy-2-ethyl-3-oxo-4-pentenoic acid IUPAC Name: (E)-5-ethoxy-2-ethyl-3-oxopent-4-enoic acid Traditional Name: (E)-5-ethoxy-2-ethyl-3-keto-pent-4-enoic acid Formula: C9H14O4 MolecularWeight: 186.20506

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)C=COCC)C(=O)O

Isomeric SMILES

CCC(C(=O)/C=C/OCC)C(=O)O

InChI

InChI=1S/C9H14O4/c1-3-7(9(11)12)8(10)5-6-13-4-2/h5-7H,3-4H2,1-2H3,(H,11,12)/b6-5+