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sodium 2-[4-(quinolin-2-ylmethoxy)phenyl]hexanoate

sodium 2-[4-(quinolin-2-ylmethoxy)phenyl]hexanoate

Systemtic Name:sodium 2-[4-(quinolin-2-ylmethoxy)phenyl]hexanoate
Openeye Name:sodium 2-[4-(2-quinolylmethoxy)phenyl]hexanoate
CAS Name:sodium 2-[4-(2-quinolinylmethoxy)phenyl]hexanoate
IUPAC Name:sodium 2-[4-(quinolin-2-ylmethoxy)phenyl]hexanoate
Traditional Name:sodium 2-[4-(2-quinolylmethoxy)phenyl]hexanoate
Formula: C22H22NNaO3
MolecularWeight: 371.40475
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1=CC=C(C=C1)OCC2=NC3=CC=CC=C3C=C2)C(=O)[O-].[Na+]


Isomeric SMILES

CCCCC(C1=CC=C(C=C1)OCC2=NC3=CC=CC=C3C=C2)C(=O)[O-].[Na+]


InChI

InChI=1S/C22H23NO3.Na/c1-2-3-7-20(22(24)25)16-10-13-19(14-11-16)26-15-18-12-9-17-6-4-5-8-21(17)23-18;/h4-6,8-14,20H,2-3,7,15H2,1H3,(H,24,25);/q;+1/p-1


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