ethyl 2-(1-dodecyl-1,2,3,4-tetrazol-5-yl)-2-fluoranyl-ethanoate

Systemtic Name: ethyl 2-(1-dodecyl-1,2,3,4-tetrazol-5-yl)-2-fluoranyl-ethanoate Openeye Name: ethyl 2-(1-dodecyltetrazol-5-yl)-2-fluoro-acetate CAS Name: 2-(1-dodecyl-5-tetrazolyl)-2-fluoroacetic acid ethyl ester IUPAC Name: ethyl 2-(1-dodecyltetrazol-5-yl)-2-fluoroacetate Traditional Name: 2-fluoro-2-(1-lauryltetrazol-5-yl)acetic acid ethyl ester Formula: C17H31FN4O2 MolecularWeight: 342.452043

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCN1C(=NN=N1)C(C(=O)OCC)F

Isomeric SMILES

CCCCCCCCCCCCN1C(=NN=N1)C(C(=O)OCC)F

InChI

InChI=1S/C17H31FN4O2/c1-3-5-6-7-8-9-10-11-12-13-14-22-16(19-20-21-22)15(18)17(23)24-4-2/h15H,3-14H2,1-2H3