(Z)-2-ethyl-3-(2-oxidanylidenepropyl)but-2-enedioic acid

Systemtic Name: (Z)-2-ethyl-3-(2-oxidanylidenepropyl)but-2-enedioic acid Openeye Name: (Z)-2-acetonyl-3-ethyl-but-2-enedioic acid CAS Name: (Z)-2-ethyl-3-(2-oxopropyl)-2-butenedioic acid IUPAC Name: (Z)-2-ethyl-3-(2-oxopropyl)but-2-enedioic acid Traditional Name: (Z)-2-acetonyl-3-ethyl-but-2-enedioic acid Formula: C9H12O5 MolecularWeight: 200.18858

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H12O5/c1-3-6(8(11)12)7(9(13)14)4-5(2)10/h3-4H2,1-2H3,(H,11,12)(H,13,14)/b7-6-