4-[[6-(3,4-dichlorophenyl)-4,5-dihydro-3H-pyridazin-2-yl]sulfonyl]benzoic acid

Systemtic Name: 4-[[6-(3,4-dichlorophenyl)-4,5-dihydro-3H-pyridazin-2-yl]sulfonyl]benzoic acid Openeye Name: 4-[[6-(3,4-dichlorophenyl)-4,5-dihydro-3H-pyridazin-2-yl]sulfonyl]benzoic acid CAS Name: 4-[[6-(3,4-dichlorophenyl)-4,5-dihydro-3H-pyridazin-2-yl]sulfonyl]benzoic acid IUPAC Name: 4-[[6-(3,4-dichlorophenyl)-4,5-dihydro-3H-pyridazin-2-yl]sulfonyl]benzoic acid Traditional Name: 4-[[6-(3,4-dichlorophenyl)-4,5-dihydro-3H-pyridazin-2-yl]sulfonyl]benzoic acid Formula: C17H14Cl2N2O4S MolecularWeight: 413.27506

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=NN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)O)C3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

C1CC(=NN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)O)C3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C17H14Cl2N2O4S/c18-14-8-5-12(10-15(14)19)16-2-1-9-21(20-16)26(24,25)13-6-3-11(4-7-13)17(22)23/h3-8,10H,1-2,9H2,(H,22,23)