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

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

Systemtic Name:2-(1-oxidanyl-1-oxidanylidene-docosan-2-yl)benzoic acid
Openeye Name:2-(1-carboxyhenicosyl)benzoic acid
CAS Name:2-(1-hydroxy-1-oxodocosan-2-yl)benzoic acid
IUPAC Name:2-(1-hydroxy-1-oxodocosan-2-yl)benzoic acid
Traditional Name:2-(1-carboxyheneicosyl)benzoic acid
Formula: C29H48O4
MolecularWeight: 460.68902
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C29H48O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23-26(28(30)31)25-22-20-21-24-27(25)29(32)33/h20-22,24,26H,2-19,23H2,1H3,(H,30,31)(H,32,33)


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