2-[(E)-2,4-dimethylhept-2-enyl]butanedioic acid

Systemtic Name: 2-[(E)-2,4-dimethylhept-2-enyl]butanedioic acid Openeye Name: 2-[(E)-2,4-dimethylhept-2-enyl]butanedioic acid CAS Name: 2-[(E)-2,4-dimethylhept-2-enyl]butanedioic acid IUPAC Name: 2-[(E)-2,4-dimethylhept-2-enyl]butanedioic acid Traditional Name: 2-[(E)-2,4-dimethylhept-2-enyl]succinic acid Formula: C13H22O4 MolecularWeight: 242.31138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C=C(C)CC(CC(=O)O)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C13H22O4/c1-4-5-9(2)6-10(3)7-11(13(16)17)8-12(14)15/h6,9,11H,4-5,7-8H2,1-3H3,(H,14,15)(H,16,17)/b10-6+