(Z)-2-[(E)-octadec-1-enyl]but-2-enedioic acid

Systemtic Name: (Z)-2-[(E)-octadec-1-enyl]but-2-enedioic acid Openeye Name: (Z)-2-[(E)-octadec-1-enyl]but-2-enedioic acid CAS Name: (Z)-2-[(E)-octadec-1-enyl]-2-butenedioic acid IUPAC Name: (Z)-2-[(E)-octadec-1-enyl]but-2-enedioic acid Traditional Name: (Z)-2-[(E)-octadec-1-enyl]but-2-enedioic acid Formula: C22H38O4 MolecularWeight: 366.53472

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC=CC(=CC(=O)O)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCC/C=C/C(=C/C(=O)O)/C(=O)O

InChI

InChI=1S/C22H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20(22(25)26)19-21(23)24/h17-19H,2-16H2,1H3,(H,23,24)(H,25,26)/b18-17+,20-19-