[5-chloranyl-4-(5,6-dihydro-1,4,2-dioxazin-3-yl)-2-methyl-pyrazol-3-yl]sulfonyl-phenyl-carbamic acid

Systemtic Name: [5-chloranyl-4-(5,6-dihydro-1,4,2-dioxazin-3-yl)-2-methyl-pyrazol-3-yl]sulfonyl-phenyl-carbamic acid Openeye Name: [5-chloro-4-(5,6-dihydro-1,4,2-dioxazin-3-yl)-2-methyl-pyrazol-3-yl]sulfonyl-phenyl-carbamic acid CAS Name: [5-chloro-4-(5,6-dihydro-1,4,2-dioxazin-3-yl)-2-methyl-3-pyrazolyl]sulfonyl-phenylcarbamic acid IUPAC Name: [5-chloro-4-(5,6-dihydro-1,4,2-dioxazin-3-yl)-2-methylpyrazol-3-yl]sulfonyl-phenylcarbamic acid Traditional Name: [5-chloro-4-(5,6-dihydro-1,4,2-dioxazin-3-yl)-2-methyl-pyrazol-3-yl]sulfonyl-phenyl-carbamic acid Formula: C14H13ClN4O6S MolecularWeight: 400.79422

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=N1)Cl)C2=NOCCO2)S(=O)(=O)N(C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CN1C(=C(C(=N1)Cl)C2=NOCCO2)S(=O)(=O)N(C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C14H13ClN4O6S/c1-18-13(10(11(15)16-18)12-17-25-8-7-24-12)26(22,23)19(14(20)21)9-5-3-2-4-6-9/h2-6H,7-8H2,1H3,(H,20,21)