2-(1-oxidanyl-1-oxidanylidene-octadecan-2-yl)benzoic acid

Systemtic Name: 2-(1-oxidanyl-1-oxidanylidene-octadecan-2-yl)benzoic acid Openeye Name: 2-(1-carboxyheptadecyl)benzoic acid CAS Name: 2-(1-hydroxy-1-oxooctadecan-2-yl)benzoic acid IUPAC Name: 2-(1-hydroxy-1-oxooctadecan-2-yl)benzoic acid Traditional Name: 2-(1-carboxyheptadecyl)benzoic acid Formula: C25H40O4 MolecularWeight: 404.5827

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(C1=CC=CC=C1C(=O)O)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCC(C1=CC=CC=C1C(=O)O)C(=O)O

InChI

InChI=1S/C25H40O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-22(24(26)27)21-18-16-17-20-23(21)25(28)29/h16-18,20,22H,2-15,19H2,1H3,(H,26,27)(H,28,29)