3-[(E)-hexadec-1-enyl]-4-methyl-furan-2,5-dione

Systemtic Name: 3-[(E)-hexadec-1-enyl]-4-methyl-furan-2,5-dione Openeye Name: 3-[(E)-hexadec-1-enyl]-4-methyl-furan-2,5-dione CAS Name: 3-[(E)-hexadec-1-enyl]-4-methylfuran-2,5-dione IUPAC Name: 3-[(E)-hexadec-1-enyl]-4-methylfuran-2,5-dione Traditional Name: 3-[(E)-hexadec-1-enyl]-4-methyl-furan-2,5-quinone Formula: C21H34O3 MolecularWeight: 334.49286

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC=CC1=C(C(=O)OC1=O)C

Isomeric SMILES

CCCCCCCCCCCCCC/C=C/C1=C(C(=O)OC1=O)C

InChI

InChI=1S/C21H34O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-18(2)20(22)24-21(19)23/h16-17H,3-15H2,1-2H3/b17-16+