(7-chloranyl-1,3-benzodioxol-5-yl)methyl 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylate

Systemtic Name: (7-chloranyl-1,3-benzodioxol-5-yl)methyl 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylate Openeye Name: (7-chloro-1,3-benzodioxol-5-yl)methyl 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylate CAS Name: 1,3-dimethyl-5-thieno[2,3-c]pyrazolecarboxylic acid (7-chloro-1,3-benzodioxol-5-yl)methyl ester IUPAC Name: (7-chloro-1,3-benzodioxol-5-yl)methyl 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylate Traditional Name: 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylic acid (7-chloro-1,3-benzodioxol-5-yl)methyl ester Formula: C16H13ClN2O4S MolecularWeight: 364.80342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=C(S2)C(=O)OCC3=CC4=C(C(=C3)Cl)OCO4)C

Isomeric SMILES

CC1=NN(C2=C1C=C(S2)C(=O)OCC3=CC4=C(C(=C3)Cl)OCO4)C

InChI

InChI=1S/C16H13ClN2O4S/c1-8-10-5-13(24-15(10)19(2)18-8)16(20)21-6-9-3-11(17)14-12(4-9)22-7-23-14/h3-5H,6-7H2,1-2H3