ethyl 2-(4-chlorophenyl)-5-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrazole-3-carboxylate

Systemtic Name: ethyl 2-(4-chlorophenyl)-5-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrazole-3-carboxylate Openeye Name: ethyl 2-(4-chlorophenyl)-5-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrazole-3-carboxylate CAS Name: 2-(4-chlorophenyl)-5-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(4-chlorophenyl)-5-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrazole-3-carboxylate Traditional Name: 2-(4-chlorophenyl)-5-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrazole-3-carboxylic acid ethyl ester Formula: C20H17ClN2O4 MolecularWeight: 384.81298

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=NN1C2=CC=C(C=C2)Cl)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CCOC(=O)C1=CC(=NN1C2=CC=C(C=C2)Cl)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C20H17ClN2O4/c1-2-25-20(24)17-12-16(22-23(17)15-6-4-14(21)5-7-15)13-3-8-18-19(11-13)27-10-9-26-18/h3-8,11-12H,2,9-10H2,1H3