4,4-bis(chloranyl)-2-ethanoyl-3-imidazol-1-yl-but-3-enoic acid

Systemtic Name: 4,4-bis(chloranyl)-2-ethanoyl-3-imidazol-1-yl-but-3-enoic acid Openeye Name: 2-acetyl-4,4-dichloro-3-imidazol-1-yl-but-3-enoic acid CAS Name: 2-acetyl-4,4-dichloro-3-(1-imidazolyl)-3-butenoic acid IUPAC Name: 2-acetyl-4,4-dichloro-3-imidazol-1-ylbut-3-enoic acid Traditional Name: 2-acetyl-4,4-dichloro-3-imidazol-1-yl-but-3-enoic acid Formula: C9H8Cl2N2O3 MolecularWeight: 263.07742

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C(=C(Cl)Cl)N1C=CN=C1)C(=O)O

Isomeric SMILES

CC(=O)C(C(=C(Cl)Cl)N1C=CN=C1)C(=O)O

InChI

InChI=1S/C9H8Cl2N2O3/c1-5(14)6(9(15)16)7(8(10)11)13-3-2-12-4-13/h2-4,6H,1H3,(H,15,16)