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sodium 5-[5-(6-phenylhexyl)thiophen-2-yl]pentanoate

sodium 5-[5-(6-phenylhexyl)thiophen-2-yl]pentanoate

Systemtic Name:sodium 5-[5-(6-phenylhexyl)thiophen-2-yl]pentanoate
Openeye Name:sodium 5-[5-(6-phenylhexyl)-2-thienyl]pentanoate
CAS Name:sodium 5-[5-(6-phenylhexyl)-2-thiophenyl]pentanoate
IUPAC Name:sodium 5-[5-(6-phenylhexyl)thiophen-2-yl]pentanoate
Traditional Name:sodium 5-[5-(6-phenylhexyl)-2-thienyl]valerate
Formula: C21H27NaO2S
MolecularWeight: 366.49265
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCCCC2=CC=C(S2)CCCCC(=O)[O-].[Na+]


Isomeric SMILES

C1=CC=C(C=C1)CCCCCCC2=CC=C(S2)CCCCC(=O)[O-].[Na+]


InChI

InChI=1S/C21H28O2S.Na/c22-21(23)15-9-8-14-20-17-16-19(24-20)13-7-2-1-4-10-18-11-5-3-6-12-18;/h3,5-6,11-12,16-17H,1-2,4,7-10,13-15H2,(H,22,23);/q;+1/p-1


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