icosyl 2-oxidanylbenzoate; 2-oxidanylbenzoate

Systemtic Name: icosyl 2-oxidanylbenzoate; 2-oxidanylbenzoate Openeye Name: 2-hydroxybenzoate; icosyl 2-hydroxybenzoate CAS Name: 2-hydroxybenzoate; 2-hydroxybenzoic acid eicosyl ester IUPAC Name: 2-hydroxybenzoate; icosyl 2-hydroxybenzoate Traditional Name: 2-hydroxybenzoic acid arachyl ester; salicylate Formula: C34H51O6- MolecularWeight: 555.76514

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCOC(=O)C1=CC=CC=C1O.C1=CC=C(C(=C1)C(=O)[O-])O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCOC(=O)C1=CC=CC=C1O.C1=CC=C(C(=C1)C(=O)[O-])O

InChI

InChI=1S/C27H46O3.C7H6O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-24-30-27(29)25-22-19-20-23-26(25)28;8-6-4-2-1-3-5(6)7(9)10/h19-20,22-23,28H,2-18,21,24H2,1H3;1-4,8H,(H,9,10)/p-1