ethyl [1-[[5-(4-iodophenyl)-5-methyl-2-oxidanylidene-oxolan-3-yl]amino]pyrazol-4-yl] carbonate

Systemtic Name: ethyl [1-[[5-(4-iodophenyl)-5-methyl-2-oxidanylidene-oxolan-3-yl]amino]pyrazol-4-yl] carbonate Openeye Name: ethyl [1-[[5-(4-iodophenyl)-5-methyl-2-oxo-tetrahydrofuran-3-yl]amino]pyrazol-4-yl] carbonate CAS Name: carbonic acid ethyl [1-[[5-(4-iodophenyl)-5-methyl-2-oxo-3-oxolanyl]amino]-4-pyrazolyl] ester IUPAC Name: ethyl [1-[[5-(4-iodophenyl)-5-methyl-2-oxooxolan-3-yl]amino]pyrazol-4-yl] carbonate Traditional Name: carbonic acid ethyl [1-[[5-(4-iodophenyl)-2-keto-5-methyl-tetrahydrofuran-3-yl]amino]pyrazol-4-yl] ester Formula: C17H18IN3O5 MolecularWeight: 471.24639

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)OC1=CN(N=C1)NC2CC(OC2=O)(C)C3=CC=C(C=C3)I

Isomeric SMILES

CCOC(=O)OC1=CN(N=C1)NC2CC(OC2=O)(C)C3=CC=C(C=C3)I

InChI

InChI=1S/C17H18IN3O5/c1-3-24-16(23)25-13-9-19-21(10-13)20-14-8-17(2,26-15(14)22)11-4-6-12(18)7-5-11/h4-7,9-10,14,20H,3,8H2,1-2H3