2-(4-cyanobutoxycarbonyl)-2-ethyl-butanoic acid

Systemtic Name: 2-(4-cyanobutoxycarbonyl)-2-ethyl-butanoic acid Openeye Name: 2-(4-cyanobutoxycarbonyl)-2-ethyl-butanoic acid CAS Name: 2-[4-cyanobutoxy(oxo)methyl]-2-ethylbutanoic acid IUPAC Name: 2-(4-cyanobutoxycarbonyl)-2-ethylbutanoic acid Traditional Name: 2-(4-cyanobutoxycarbonyl)-2-ethyl-butyric acid Formula: C12H19NO4 MolecularWeight: 241.28356

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C(=O)O)C(=O)OCCCCC#N

Isomeric SMILES

CCC(CC)(C(=O)O)C(=O)OCCCCC#N

InChI

InChI=1S/C12H19NO4/c1-3-12(4-2,10(14)15)11(16)17-9-7-5-6-8-13/h3-7,9H2,1-2H3,(H,14,15)