(4E)-4-[(E)-hentetracont-9-en-19-ylidene]oxetan-2-one

Systemtic Name: (4E)-4-[(E)-hentetracont-9-en-19-ylidene]oxetan-2-one Openeye Name: (4E)-4-[1-[(E)-octadec-9-enyl]tricosylidene]oxetan-2-one CAS Name: (4E)-4-[(E)-hentetracont-9-en-19-ylidene]-2-oxetanone IUPAC Name: (4E)-4-[(E)-hentetracont-9-en-19-ylidene]oxetan-2-one Traditional Name: (4E)-4-[(E)-1-behenylnonadec-10-enylidene]oxetan-2-one Formula: C44H82O2 MolecularWeight: 643.12068

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCC(=C1CC(=O)O1)CCCCCCCCC=CCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCC/C(=C\1/CC(=O)O1)/CCCCCCCC/C=C/CCCCCCCC

InChI

InChI=1S/C44H82O2/c1-3-5-7-9-11-13-15-17-19-21-22-23-24-26-28-30-32-34-36-38-40-42(43-41-44(45)46-43)39-37-35-33-31-29-27-25-20-18-16-14-12-10-8-6-4-2/h18,20H,3-17,19,21-41H2,1-2H3/b20-18+,43-42-