(E)-but-2-enedioic acid; [(E)-2-chloranylethenyl]benzene

Systemtic Name: (E)-but-2-enedioic acid; [(E)-2-chloranylethenyl]benzene Openeye Name: [(E)-2-chlorovinyl]benzene; fumaric acid CAS Name: (E)-2-butenedioic acid; [(E)-2-chloroethenyl]benzene IUPAC Name: (E)-but-2-enedioic acid; [(E)-2-chloroethenyl]benzene Traditional Name: [(E)-2-chlorovinyl]benzene; fumaric acid Formula: C12H11ClO4 MolecularWeight: 254.66634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CCl.C(=CC(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)/C=C/Cl.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C8H7Cl.C4H4O4/c9-7-6-8-4-2-1-3-5-8;5-3(6)1-2-4(7)8/h1-7H;1-2H,(H,5,6)(H,7,8)/b7-6+;2-1+