hexacosyl 2-oxidanylbenzoate; 2-oxidanylbenzoate

Systemtic Name: hexacosyl 2-oxidanylbenzoate; 2-oxidanylbenzoate Openeye Name: hexacosyl 2-hydroxybenzoate; 2-hydroxybenzoate CAS Name: 2-hydroxybenzoate; 2-hydroxybenzoic acid hexacosyl ester IUPAC Name: hexacosyl 2-hydroxybenzoate; 2-hydroxybenzoate Traditional Name: 2-hydroxybenzoic acid hexacosyl ester; salicylate Formula: C40H63O6- MolecularWeight: 639.92462

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C33H58O3.C7H6O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-27-30-36-33(35)31-28-25-26-29-32(31)34;8-6-4-2-1-3-5(6)7(9)10/h25-26,28-29,34H,2-24,27,30H2,1H3;1-4,8H,(H,9,10)/p-1