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3-[2-(2,2-dimethylbutanoylamino)ethoxycarbonyl]pyrazine-2-carboxylic acid

3-[2-(2,2-dimethylbutanoylamino)ethoxycarbonyl]pyrazine-2-carboxylic acid

Systemtic Name:3-[2-(2,2-dimethylbutanoylamino)ethoxycarbonyl]pyrazine-2-carboxylic acid
Openeye Name:3-[2-(2,2-dimethylbutanoylamino)ethoxycarbonyl]pyrazine-2-carboxylic acid
CAS Name:3-[2-[(2,2-dimethyl-1-oxobutyl)amino]ethoxy-oxomethyl]-2-pyrazinecarboxylic acid
IUPAC Name:3-[2-(2,2-dimethylbutanoylamino)ethoxycarbonyl]pyrazine-2-carboxylic acid
Traditional Name:3-[2-(2,2-dimethylbutanoylamino)ethoxycarbonyl]pyrazinoic acid
Formula: C14H19N3O5
MolecularWeight: 309.31776
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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C(=O)NCCOC(=O)C1=NC=CN=C1C(=O)O


Isomeric SMILES

CCC(C)(C)C(=O)NCCOC(=O)C1=NC=CN=C1C(=O)O


InChI

InChI=1S/C14H19N3O5/c1-4-14(2,3)13(21)17-7-8-22-12(20)10-9(11(18)19)15-5-6-16-10/h5-6H,4,7-8H2,1-3H3,(H,17,21)(H,18,19)


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