(E)-2-(3-chloranyl-4-methyl-phenyl)but-2-enedioate

Systemtic Name: (E)-2-(3-chloranyl-4-methyl-phenyl)but-2-enedioate Openeye Name: (E)-2-(3-chloro-4-methyl-phenyl)but-2-enedioate CAS Name: (E)-2-(3-chloro-4-methylphenyl)-2-butenedioate IUPAC Name: (E)-2-(3-chloro-4-methylphenyl)but-2-enedioate Traditional Name: (E)-2-(3-chloro-4-methyl-phenyl)but-2-enedioate Formula: C11H7ClO4-2 MolecularWeight: 238.62388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=CC(=O)[O-])C(=O)[O-])Cl

Isomeric SMILES

CC1=C(C=C(C=C1)/C(=C\C(=O)[O-])/C(=O)[O-])Cl

InChI

InChI=1S/C11H9ClO4/c1-6-2-3-7(4-9(6)12)8(11(15)16)5-10(13)14/h2-5H,1H3,(H,13,14)(H,15,16)/p-2/b8-5+