(E)-octadec-9-enoate; 2-oxidanylbenzoate

Systemtic Name: (E)-octadec-9-enoate; 2-oxidanylbenzoate Openeye Name: 2-hydroxybenzoate; (E)-octadec-9-enoate CAS Name: 2-hydroxybenzoate; (E)-9-octadecenoate IUPAC Name: 2-hydroxybenzoate; (E)-octadec-9-enoate Traditional Name: (E)-octadec-9-enoate; salicylate Formula: C25H38O5-2 MolecularWeight: 418.56622

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)[O-].C1=CC=C(C(=C1)C(=O)[O-])O

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)[O-].C1=CC=C(C(=C1)C(=O)[O-])O

InChI

InChI=1S/C18H34O2.C7H6O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;8-6-4-2-1-3-5(6)7(9)10/h9-10H,2-8,11-17H2,1H3,(H,19,20);1-4,8H,(H,9,10)/p-2/b10-9+;