(7-chloranyl-1,3-benzodioxol-5-yl)methyl 2-oxidanylidene-2-(1,3,5-trimethylpyrazol-4-yl)ethanoate

Systemtic Name: (7-chloranyl-1,3-benzodioxol-5-yl)methyl 2-oxidanylidene-2-(1,3,5-trimethylpyrazol-4-yl)ethanoate Openeye Name: (7-chloro-1,3-benzodioxol-5-yl)methyl 2-oxo-2-(1,3,5-trimethylpyrazol-4-yl)acetate CAS Name: 2-oxo-2-(1,3,5-trimethyl-4-pyrazolyl)acetic acid (7-chloro-1,3-benzodioxol-5-yl)methyl ester IUPAC Name: (7-chloro-1,3-benzodioxol-5-yl)methyl 2-oxo-2-(1,3,5-trimethylpyrazol-4-yl)acetate Traditional Name: 2-keto-2-(1,3,5-trimethylpyrazol-4-yl)acetic acid (7-chloro-1,3-benzodioxol-5-yl)methyl ester Formula: C16H15ClN2O5 MolecularWeight: 350.7537

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)C(=O)C(=O)OCC2=CC3=C(C(=C2)Cl)OCO3

Isomeric SMILES

CC1=C(C(=NN1C)C)C(=O)C(=O)OCC2=CC3=C(C(=C2)Cl)OCO3

InChI

InChI=1S/C16H15ClN2O5/c1-8-13(9(2)19(3)18-8)14(20)16(21)22-6-10-4-11(17)15-12(5-10)23-7-24-15/h4-5H,6-7H2,1-3H3