4-chloranyl-N1-methyl-N1-[(2-methyl-5-oxidanylidene-oxolan-2-yl)methyl]benzene-1,3-disulfonamide

Systemtic Name: 4-chloranyl-N1-methyl-N1-[(2-methyl-5-oxidanylidene-oxolan-2-yl)methyl]benzene-1,3-disulfonamide Openeye Name: 4-chloro-N1-methyl-N1-[(2-methyl-5-oxo-tetrahydrofuran-2-yl)methyl]benzene-1,3-disulfonamide CAS Name: 4-chloro-N1-methyl-N1-[(2-methyl-5-oxo-2-oxolanyl)methyl]benzene-1,3-disulfonamide IUPAC Name: 4-chloro-1-N-methyl-1-N-[(2-methyl-5-oxooxolan-2-yl)methyl]benzene-1,3-disulfonamide Traditional Name: 4-chloro-N-[(5-keto-2-methyl-tetrahydrofuran-2-yl)methyl]-N-methyl-benzene-1,3-disulfonamide Formula: C13H17ClN2O6S2 MolecularWeight: 396.86688

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(=O)O1)CN(C)S(=O)(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N

Isomeric SMILES

CC1(CCC(=O)O1)CN(C)S(=O)(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N

InChI

InChI=1S/C13H17ClN2O6S2/c1-13(6-5-12(17)22-13)8-16(2)24(20,21)9-3-4-10(14)11(7-9)23(15,18)19/h3-4,7H,5-6,8H2,1-2H3,(H2,15,18,19)