1,3-benzodioxol-5-yl 1-[(2-chlorophenyl)methyl]pyrazole-4-carboxylate

Systemtic Name: 1,3-benzodioxol-5-yl 1-[(2-chlorophenyl)methyl]pyrazole-4-carboxylate Openeye Name: 1,3-benzodioxol-5-yl 1-[(2-chlorophenyl)methyl]pyrazole-4-carboxylate CAS Name: 1-[(2-chlorophenyl)methyl]-4-pyrazolecarboxylic acid 1,3-benzodioxol-5-yl ester IUPAC Name: 1,3-benzodioxol-5-yl 1-[(2-chlorophenyl)methyl]pyrazole-4-carboxylate Traditional Name: 1-(2-chlorobenzyl)pyrazole-4-carboxylic acid 1,3-benzodioxol-5-yl ester Formula: C18H13ClN2O4 MolecularWeight: 356.75982

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)OC(=O)C3=CN(N=C3)CC4=CC=CC=C4Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)OC(=O)C3=CN(N=C3)CC4=CC=CC=C4Cl

InChI

InChI=1S/C18H13ClN2O4/c19-15-4-2-1-3-12(15)9-21-10-13(8-20-21)18(22)25-14-5-6-16-17(7-14)24-11-23-16/h1-8,10H,9,11H2