ethyl 2-[3-[2-(4-iodanylpyrazol-1-yl)ethanoylamino]pyrazol-1-yl]ethanoate

Systemtic Name: ethyl 2-[3-[2-(4-iodanylpyrazol-1-yl)ethanoylamino]pyrazol-1-yl]ethanoate Openeye Name: ethyl 2-[3-[[2-(4-iodopyrazol-1-yl)acetyl]amino]pyrazol-1-yl]acetate CAS Name: 2-[3-[[2-(4-iodo-1-pyrazolyl)-1-oxoethyl]amino]-1-pyrazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-[[2-(4-iodopyrazol-1-yl)acetyl]amino]pyrazol-1-yl]acetate Traditional Name: 2-[3-[[2-(4-iodopyrazol-1-yl)acetyl]amino]pyrazol-1-yl]acetic acid ethyl ester Formula: C12H14IN5O3 MolecularWeight: 403.17573

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C=CC(=N1)NC(=O)CN2C=C(C=N2)I

Isomeric SMILES

CCOC(=O)CN1C=CC(=N1)NC(=O)CN2C=C(C=N2)I

InChI

InChI=1S/C12H14IN5O3/c1-2-21-12(20)8-17-4-3-10(16-17)15-11(19)7-18-6-9(13)5-14-18/h3-6H,2,7-8H2,1H3,(H,15,16,19)