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sodium 6-[(5-chloranyl-2-propan-2-yloxy-phenyl)methyl]pyridine-2-carboxylate

sodium 6-[(5-chloranyl-2-propan-2-yloxy-phenyl)methyl]pyridine-2-carboxylate

Systemtic Name:sodium 6-[(5-chloranyl-2-propan-2-yloxy-phenyl)methyl]pyridine-2-carboxylate
Openeye Name:sodium 6-[(5-chloro-2-isopropoxy-phenyl)methyl]pyridine-2-carboxylate
CAS Name:sodium 6-[(5-chloro-2-propan-2-yloxyphenyl)methyl]-2-pyridinecarboxylate
IUPAC Name:sodium 6-[(5-chloro-2-propan-2-yloxyphenyl)methyl]pyridine-2-carboxylate
Traditional Name:sodium 6-(5-chloro-2-isopropoxy-benzyl)picolinate
Formula: C16H15ClNNaO3
MolecularWeight: 327.73797
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)Cl)CC2=CC=CC(=N2)C(=O)[O-].[Na+]


Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)Cl)CC2=CC=CC(=N2)C(=O)[O-].[Na+]


InChI

InChI=1S/C16H16ClNO3.Na/c1-10(2)21-15-7-6-12(17)8-11(15)9-13-4-3-5-14(18-13)16(19)20;/h3-8,10H,9H2,1-2H3,(H,19,20);/q;+1/p-1


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