4-(4-methylphenyl)sulfonylbutyl 2-(methylsulfonylcarbamoylamino)benzoate

Systemtic Name: 4-(4-methylphenyl)sulfonylbutyl 2-(methylsulfonylcarbamoylamino)benzoate Openeye Name: 4-(p-tolylsulfonyl)butyl 2-(methylsulfonylcarbamoylamino)benzoate CAS Name: 2-[[methanesulfonamido(oxo)methyl]amino]benzoic acid 4-(4-methylphenyl)sulfonylbutyl ester IUPAC Name: 4-(4-methylphenyl)sulfonylbutyl 2-(methylsulfonylcarbamoylamino)benzoate Traditional Name: 2-(mesylcarbamoylamino)benzoic acid 4-tosylbutyl ester Formula: C20H24N2O7S2 MolecularWeight: 468.54376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCCCOC(=O)C2=CC=CC=C2NC(=O)NS(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCCCOC(=O)C2=CC=CC=C2NC(=O)NS(=O)(=O)C

InChI

InChI=1S/C20H24N2O7S2/c1-15-9-11-16(12-10-15)31(27,28)14-6-5-13-29-19(23)17-7-3-4-8-18(17)21-20(24)22-30(2,25)26/h3-4,7-12H,5-6,13-14H2,1-2H3,(H2,21,22,24)