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6-[2-(4-tert-butylphenyl)ethynyl]pyridine-3-carboxylate

6-[2-(4-tert-butylphenyl)ethynyl]pyridine-3-carboxylate

Systemtic Name:6-[2-(4-tert-butylphenyl)ethynyl]pyridine-3-carboxylate
Openeye Name:6-[2-(4-tert-butylphenyl)ethynyl]pyridine-3-carboxylate
CAS Name:6-[2-(4-tert-butylphenyl)ethynyl]-3-pyridinecarboxylate
IUPAC Name:6-[2-(4-tert-butylphenyl)ethynyl]pyridine-3-carboxylate
Traditional Name:6-[2-(4-tert-butylphenyl)ethynyl]nicotinate
Formula: C18H16NO2-
MolecularWeight: 278.32514
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C#CC2=NC=C(C=C2)C(=O)[O-]


Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C#CC2=NC=C(C=C2)C(=O)[O-]


InChI

InChI=1S/C18H17NO2/c1-18(2,3)15-8-4-13(5-9-15)6-10-16-11-7-14(12-19-16)17(20)21/h4-5,7-9,11-12H,1-3H3,(H,20,21)/p-1


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