4,5-bis(oxidanyl)-5-(2-oxidanylidenebutyl)heptacosane-3,6-dione

Systemtic Name: 4,5-bis(oxidanyl)-5-(2-oxidanylidenebutyl)heptacosane-3,6-dione Openeye Name: 4,5-dihydroxy-5-(2-oxobutyl)heptacosane-3,6-dione CAS Name: 4,5-dihydroxy-5-(2-oxobutyl)heptacosane-3,6-dione IUPAC Name: 4,5-dihydroxy-5-(2-oxobutyl)heptacosane-3,6-dione Traditional Name: 4,5-dihydroxy-5-(2-ketobutyl)heptacosane-3,6-dione Formula: C31H58O5 MolecularWeight: 510.78922

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCC(=O)C(CC(=O)CC)(C(C(=O)CC)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCC(=O)C(CC(=O)CC)(C(C(=O)CC)O)O

InChI

InChI=1S/C31H58O5/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-29(34)31(36,26-27(32)5-2)30(35)28(33)6-3/h30,35-36H,4-26H2,1-3H3