4-(6-oxidanylidene-4-propan-2-yl-4,5-dihydro-1H-pyridazin-3-yl)benzenesulfinic acid

Systemtic Name: 4-(6-oxidanylidene-4-propan-2-yl-4,5-dihydro-1H-pyridazin-3-yl)benzenesulfinic acid Openeye Name: 4-(4-isopropyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)benzenesulfinic acid CAS Name: 4-(6-oxo-4-propan-2-yl-4,5-dihydro-1H-pyridazin-3-yl)benzenesulfinic acid IUPAC Name: 4-(6-oxo-4-propan-2-yl-4,5-dihydro-1H-pyridazin-3-yl)benzenesulfinic acid Traditional Name: 4-(4-isopropyl-6-keto-4,5-dihydro-1H-pyridazin-3-yl)benzenesulfinic acid Formula: C13H16N2O3S MolecularWeight: 280.34274

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1CC(=O)NN=C1C2=CC=C(C=C2)S(=O)O

Isomeric SMILES

CC(C)C1CC(=O)NN=C1C2=CC=C(C=C2)S(=O)O

InChI

InChI=1S/C13H16N2O3S/c1-8(2)11-7-12(16)14-15-13(11)9-3-5-10(6-4-9)19(17)18/h3-6,8,11H,7H2,1-2H3,(H,14,16)(H,17,18)