dibenzofuran-2-yl 5-chloranyl-1,3-dimethyl-pyrazole-4-carboxylate

Systemtic Name: dibenzofuran-2-yl 5-chloranyl-1,3-dimethyl-pyrazole-4-carboxylate Openeye Name: dibenzofuran-2-yl 5-chloro-1,3-dimethyl-pyrazole-4-carboxylate CAS Name: 5-chloro-1,3-dimethyl-4-pyrazolecarboxylic acid 2-dibenzofuranyl ester IUPAC Name: dibenzofuran-2-yl 5-chloro-1,3-dimethylpyrazole-4-carboxylate Traditional Name: 5-chloro-1,3-dimethyl-pyrazole-4-carboxylic acid dibenzofuran-2-yl ester Formula: C18H13ClN2O3 MolecularWeight: 340.76042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)OC2=CC3=C(C=C2)OC4=CC=CC=C43)Cl)C

Isomeric SMILES

CC1=NN(C(=C1C(=O)OC2=CC3=C(C=C2)OC4=CC=CC=C43)Cl)C

InChI

InChI=1S/C18H13ClN2O3/c1-10-16(17(19)21(2)20-10)18(22)23-11-7-8-15-13(9-11)12-5-3-4-6-14(12)24-15/h3-9H,1-2H3