ethyl 1-[3,4-diacetyloxy-5-(acetyloxymethyl)oxolan-2-yl]pyrazole-3-carboxylate

Systemtic Name: ethyl 1-[3,4-diacetyloxy-5-(acetyloxymethyl)oxolan-2-yl]pyrazole-3-carboxylate Openeye Name: ethyl 1-[3,4-diacetoxy-5-(acetoxymethyl)tetrahydrofuran-2-yl]pyrazole-3-carboxylate CAS Name: 1-[3,4-diacetyloxy-5-(acetyloxymethyl)-2-oxolanyl]-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3,4-diacetyloxy-5-(acetyloxymethyl)oxolan-2-yl]pyrazole-3-carboxylate Traditional Name: 1-[3,4-diacetoxy-5-(acetoxymethyl)tetrahydrofuran-2-yl]pyrazole-3-carboxylic acid ethyl ester Formula: C17H22N2O9 MolecularWeight: 398.36458

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C=C1)C2C(C(C(O2)COC(=O)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CCOC(=O)C1=NN(C=C1)C2C(C(C(O2)COC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C17H22N2O9/c1-5-24-17(23)12-6-7-19(18-12)16-15(27-11(4)22)14(26-10(3)21)13(28-16)8-25-9(2)20/h6-7,13-16H,5,8H2,1-4H3