4-[(4-chlorophenyl)sulfonyl-[(2-hydroxyphenyl)methyl]amino]-1-ethyl-pyrazole-3-carboxylic acid

Systemtic Name: 4-[(4-chlorophenyl)sulfonyl-[(2-hydroxyphenyl)methyl]amino]-1-ethyl-pyrazole-3-carboxylic acid Openeye Name: 4-[(4-chlorophenyl)sulfonyl-[(2-hydroxyphenyl)methyl]amino]-1-ethyl-pyrazole-3-carboxylic acid CAS Name: 4-[(4-chlorophenyl)sulfonyl-[(2-hydroxyphenyl)methyl]amino]-1-ethyl-3-pyrazolecarboxylic acid IUPAC Name: 4-[(4-chlorophenyl)sulfonyl-[(2-hydroxyphenyl)methyl]amino]-1-ethylpyrazole-3-carboxylic acid Traditional Name: 4-[(4-chlorophenyl)sulfonyl-salicyl-amino]-1-ethyl-pyrazole-3-carboxylic acid Formula: C19H18ClN3O5S MolecularWeight: 435.88132

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)O)N(CC2=CC=CC=C2O)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)O)N(CC2=CC=CC=C2O)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H18ClN3O5S/c1-2-22-12-16(18(21-22)19(25)26)23(11-13-5-3-4-6-17(13)24)29(27,28)15-9-7-14(20)8-10-15/h3-10,12,24H,2,11H2,1H3,(H,25,26)