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sodium 2-octadecoxycarbonylbenzoate

sodium 2-octadecoxycarbonylbenzoate

Systemtic Name:sodium 2-octadecoxycarbonylbenzoate
Openeye Name:sodium 2-octadecoxycarbonylbenzoate
CAS Name:sodium 2-[octadecoxy(oxo)methyl]benzoate
IUPAC Name:sodium 2-octadecoxycarbonylbenzoate
Traditional Name:sodium 2-stearyloxycarbonylbenzoate
Formula: C26H41NaO4
MolecularWeight: 440.59111
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)[O-].[Na+]


Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)[O-].[Na+]


InChI

InChI=1S/C26H42O4.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22-30-26(29)24-21-18-17-20-23(24)25(27)28;/h17-18,20-21H,2-16,19,22H2,1H3,(H,27,28);/q;+1/p-1


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