5-ethoxy-1-(4-methylphenyl)sulfonyl-4H-cyclopenta[c]pyrazole-3-carboxylic acid

Systemtic Name: 5-ethoxy-1-(4-methylphenyl)sulfonyl-4H-cyclopenta[c]pyrazole-3-carboxylic acid Openeye Name: 5-ethoxy-1-(p-tolylsulfonyl)-4H-cyclopenta[c]pyrazole-3-carboxylic acid CAS Name: 5-ethoxy-1-(4-methylphenyl)sulfonyl-4H-cyclopenta[c]pyrazole-3-carboxylic acid IUPAC Name: 5-ethoxy-1-(4-methylphenyl)sulfonyl-4H-cyclopenta[c]pyrazole-3-carboxylic acid Traditional Name: 5-ethoxy-1-tosyl-4H-cyclopenta[c]pyrazole-3-carboxylic acid Formula: C16H16N2O5S MolecularWeight: 348.37364

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C1)C(=NN2S(=O)(=O)C3=CC=C(C=C3)C)C(=O)O

Isomeric SMILES

CCOC1=CC2=C(C1)C(=NN2S(=O)(=O)C3=CC=C(C=C3)C)C(=O)O

InChI

InChI=1S/C16H16N2O5S/c1-3-23-11-8-13-14(9-11)18(17-15(13)16(19)20)24(21,22)12-6-4-10(2)5-7-12/h4-7,9H,3,8H2,1-2H3,(H,19,20)