[acetyloxy-(3,5-dimethyl-1-propyl-pyrazol-4-yl)-$l^{3}-iodanyl] ethanoate

Systemtic Name: [acetyloxy-(3,5-dimethyl-1-propyl-pyrazol-4-yl)-$l^{3}-iodanyl] ethanoate Openeye Name: [acetoxy-(3,5-dimethyl-1-propyl-pyrazol-4-yl)-$l^{3}-iodanyl] acetate CAS Name: acetic acid [acetyloxy-(3,5-dimethyl-1-propyl-4-pyrazolyl)-$l^{3}-iodanyl] ester IUPAC Name: [acetyloxy-(3,5-dimethyl-1-propylpyrazol-4-yl)-$l^{3}-iodanyl] acetate Traditional Name: acetic acid [acetoxy-(3,5-dimethyl-1-propyl-pyrazol-4-yl)iodinanyl] ester Formula: C12H19IN2O4 MolecularWeight: 382.19473

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(=N1)C)I(OC(=O)C)OC(=O)C)C

Isomeric SMILES

CCCN1C(=C(C(=N1)C)I(OC(=O)C)OC(=O)C)C

InChI

InChI=1S/C12H19IN2O4/c1-6-7-15-9(3)12(8(2)14-15)13(18-10(4)16)19-11(5)17/h6-7H2,1-5H3