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sodium 2-octylbenzoate

sodium 2-octylbenzoate

Systemtic Name:sodium 2-octylbenzoate
Openeye Name:sodium 2-octylbenzoate
CAS Name:sodium 2-octylbenzoate
IUPAC Name:sodium 2-octylbenzoate
Traditional Name:sodium 2-octylbenzoate
Formula: C15H21NaO2
MolecularWeight: 256.31581
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=CC=C1C(=O)[O-].[Na+]


Isomeric SMILES

CCCCCCCCC1=CC=CC=C1C(=O)[O-].[Na+]


InChI

InChI=1S/C15H22O2.Na/c1-2-3-4-5-6-7-10-13-11-8-9-12-14(13)15(16)17;/h8-9,11-12H,2-7,10H2,1H3,(H,16,17);/q;+1/p-1


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