2,3-dihydro-1,4-benzodioxin-3-ylmethyl 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylate

Systemtic Name: 2,3-dihydro-1,4-benzodioxin-3-ylmethyl 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylate Openeye Name: 2,3-dihydro-1,4-benzodioxin-3-ylmethyl 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylate CAS Name: 1,3-dimethyl-5-thieno[2,3-c]pyrazolecarboxylic acid 2,3-dihydro-1,4-benzodioxin-3-ylmethyl ester IUPAC Name: 2,3-dihydro-1,4-benzodioxin-3-ylmethyl 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylate Traditional Name: 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylic acid 2,3-dihydro-1,4-benzodioxin-3-ylmethyl ester Formula: C17H16N2O4S MolecularWeight: 344.38494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=C(S2)C(=O)OCC3COC4=CC=CC=C4O3)C

Isomeric SMILES

CC1=NN(C2=C1C=C(S2)C(=O)OCC3COC4=CC=CC=C4O3)C

InChI

InChI=1S/C17H16N2O4S/c1-10-12-7-15(24-16(12)19(2)18-10)17(20)22-9-11-8-21-13-5-3-4-6-14(13)23-11/h3-7,11H,8-9H2,1-2H3