(6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl 1,5-dimethylpyrazole-4-carboxylate

Systemtic Name: (6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl 1,5-dimethylpyrazole-4-carboxylate Openeye Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl 1,5-dimethylpyrazole-4-carboxylate CAS Name: 1,5-dimethyl-4-pyrazolecarboxylic acid (6-chloro-4H-1,3-benzodioxin-8-yl)methyl ester IUPAC Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl 1,5-dimethylpyrazole-4-carboxylate Traditional Name: 1,5-dimethylpyrazole-4-carboxylic acid (6-chloro-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C15H15ClN2O4 MolecularWeight: 322.7436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C)C(=O)OCC2=C3C(=CC(=C2)Cl)COCO3

Isomeric SMILES

CC1=C(C=NN1C)C(=O)OCC2=C3C(=CC(=C2)Cl)COCO3

InChI

InChI=1S/C15H15ClN2O4/c1-9-13(5-17-18(9)2)15(19)21-7-11-4-12(16)3-10-6-20-8-22-14(10)11/h3-5H,6-8H2,1-2H3