(Z)-2-chloranylbut-2-enedioic acid; 3-[(E)-non-1-enyl]oxolane-2,5-dione

Systemtic Name: (Z)-2-chloranylbut-2-enedioic acid; 3-[(E)-non-1-enyl]oxolane-2,5-dione Openeye Name: (Z)-2-chlorobut-2-enedioic acid; 3-[(E)-non-1-enyl]tetrahydrofuran-2,5-dione CAS Name: (Z)-2-chloro-2-butenedioic acid; 3-[(E)-non-1-enyl]oxolane-2,5-dione IUPAC Name: (Z)-2-chlorobut-2-enedioic acid; 3-[(E)-non-1-enyl]oxolane-2,5-dione Traditional Name: (Z)-2-chlorobut-2-enedioic acid; 3-[(E)-non-1-enyl]tetrahydrofuran-2,5-quinone Formula: C17H23ClO7 MolecularWeight: 374.81332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC=CC1CC(=O)OC1=O.C(=C(C(=O)O)Cl)C(=O)O

Isomeric SMILES

CCCCCCC/C=C/C1CC(=O)OC1=O.C(=C(/C(=O)O)\Cl)\C(=O)O

InChI

InChI=1S/C13H20O3.C4H3ClO4/c1-2-3-4-5-6-7-8-9-11-10-12(14)16-13(11)15;5-2(4(8)9)1-3(6)7/h8-9,11H,2-7,10H2,1H3;1H,(H,6,7)(H,8,9)/b9-8+;2-1-