N-[2-(1,3-benzodioxol-5-yl)-3-oxidanyl-4-oxidanylidene-chromen-6-yl]-4-chloranyl-3-nitro-benzenesulfonamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)-3-oxidanyl-4-oxidanylidene-chromen-6-yl]-4-chloranyl-3-nitro-benzenesulfonamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)-3-hydroxy-4-oxo-chromen-6-yl]-4-chloro-3-nitro-benzenesulfonamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)-3-hydroxy-4-oxo-1-benzopyran-6-yl]-4-chloro-3-nitrobenzenesulfonamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)-3-hydroxy-4-oxochromen-6-yl]-4-chloro-3-nitrobenzenesulfonamide Traditional Name: N-[2-(1,3-benzodioxol-5-yl)-3-hydroxy-4-keto-chromen-6-yl]-4-chloro-3-nitro-benzenesulfonamide Formula: C22H13ClN2O9S MolecularWeight: 516.86462

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=C(C(=O)C4=C(O3)C=CC(=C4)NS(=O)(=O)C5=CC(=C(C=C5)Cl)[N+](=O)[O-])O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=C(C(=O)C4=C(O3)C=CC(=C4)NS(=O)(=O)C5=CC(=C(C=C5)Cl)[N+](=O)[O-])O

InChI

InChI=1S/C22H13ClN2O9S/c23-15-4-3-13(9-16(15)25(28)29)35(30,31)24-12-2-6-17-14(8-12)20(26)21(27)22(34-17)11-1-5-18-19(7-11)33-10-32-18/h1-9,24,27H,10H2