4-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]butyl 4-[(4-methylphenyl)sulfonylcarbamoylamino]benzoate

Systemtic Name: 4-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]butyl 4-[(4-methylphenyl)sulfonylcarbamoylamino]benzoate Openeye Name: 4-(2,5-dioxopyrrolidin-1-yl)butyl 4-(p-tolylsulfonylcarbamoylamino)benzoate CAS Name: 4-[[[(4-methylphenyl)sulfonylamino]-oxomethyl]amino]benzoic acid 4-(2,5-dioxo-1-pyrrolidinyl)butyl ester IUPAC Name: 4-(2,5-dioxopyrrolidin-1-yl)butyl 4-[(4-methylphenyl)sulfonylcarbamoylamino]benzoate Traditional Name: 4-(tosylcarbamoylamino)benzoic acid 4-succinimidobutyl ester Formula: C23H25N3O7S MolecularWeight: 487.5255

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NC2=CC=C(C=C2)C(=O)OCCCCN3C(=O)CCC3=O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NC2=CC=C(C=C2)C(=O)OCCCCN3C(=O)CCC3=O

InChI

InChI=1S/C23H25N3O7S/c1-16-4-10-19(11-5-16)34(31,32)25-23(30)24-18-8-6-17(7-9-18)22(29)33-15-3-2-14-26-20(27)12-13-21(26)28/h4-11H,2-3,12-15H2,1H3,(H2,24,25,30)