20-butanoyl-19-oxidanyl-18,22-bis(oxidanylidene)nonatriacontan-20-olate

Systemtic Name: 20-butanoyl-19-oxidanyl-18,22-bis(oxidanylidene)nonatriacontan-20-olate Openeye Name: 20-butanoyl-19-hydroxy-18,22-dioxo-nonatriacontan-20-olate CAS Name: 19-hydroxy-18,22-dioxo-20-(1-oxobutyl)-20-nonatriacontanolate IUPAC Name: 20-butanoyl-19-hydroxy-18,22-dioxononatriacontan-20-olate Traditional Name: 20-butyryl-19-hydroxy-18,22-diketo-nonatriacontan-20-olate Formula: C43H81O5- MolecularWeight: 678.10024

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)CC(C(C(=O)CCCCCCCCCCCCCCCCC)O)(C(=O)CCC)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)CC(C(C(=O)CCCCCCCCCCCCCCCCC)O)(C(=O)CCC)[O-]

InChI

InChI=1S/C43H81O5/c1-4-7-9-11-13-15-17-19-21-23-25-27-29-31-33-36-39(44)38-43(48,41(46)35-6-3)42(47)40(45)37-34-32-30-28-26-24-22-20-18-16-14-12-10-8-5-2/h42,47H,4-38H2,1-3H3/q-1