3-(8,8-diheptoxyoctoxy)-2-oxidanyl-benzoate

Systemtic Name: 3-(8,8-diheptoxyoctoxy)-2-oxidanyl-benzoate Openeye Name: 3-(8,8-diheptoxyoctoxy)-2-hydroxy-benzoate CAS Name: 3-(8,8-diheptoxyoctoxy)-2-hydroxybenzoate IUPAC Name: 3-(8,8-diheptoxyoctoxy)-2-hydroxybenzoate Traditional Name: 3-(8,8-diheptoxyoctoxy)-2-hydroxy-benzoate Formula: C29H49O6- MolecularWeight: 493.69576

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(CCCCCCCOC1=CC=CC(=C1O)C(=O)[O-])OCCCCCCC

Isomeric SMILES

CCCCCCCOC(CCCCCCCOC1=CC=CC(=C1O)C(=O)[O-])OCCCCCCC

InChI

InChI=1S/C29H50O6/c1-3-5-7-11-16-23-34-27(35-24-17-12-8-6-4-2)21-14-10-9-13-15-22-33-26-20-18-19-25(28(26)30)29(31)32/h18-20,27,30H,3-17,21-24H2,1-2H3,(H,31,32)/p-1