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sodium (E)-8-oxidanyl-8-(2-pentoxyphenyl)oct-5-enoate

sodium (E)-8-oxidanyl-8-(2-pentoxyphenyl)oct-5-enoate

Systemtic Name:sodium (E)-8-oxidanyl-8-(2-pentoxyphenyl)oct-5-enoate
Openeye Name:sodium (E)-8-hydroxy-8-(2-pentoxyphenyl)oct-5-enoate
CAS Name:sodium (E)-8-hydroxy-8-(2-pentoxyphenyl)-5-octenoate
IUPAC Name:sodium (E)-8-hydroxy-8-(2-pentoxyphenyl)oct-5-enoate
Traditional Name:sodium (E)-8-(2-amoxyphenyl)-8-hydroxy-oct-5-enoate
Formula: C19H27NaO4
MolecularWeight: 342.40505
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=CC=C1C(CC=CCCCC(=O)[O-])O.[Na+]


Isomeric SMILES

CCCCCOC1=CC=CC=C1C(C/C=C/CCCC(=O)[O-])O.[Na+]


InChI

InChI=1S/C19H28O4.Na/c1-2-3-10-15-23-18-13-9-8-11-16(18)17(20)12-6-4-5-7-14-19(21)22;/h4,6,8-9,11,13,17,20H,2-3,5,7,10,12,14-15H2,1H3,(H,21,22);/q;+1/p-1/b6-4+;


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