2-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]ethyl 3-[(4-methylphenyl)sulfonylcarbamoylamino]benzoate

Systemtic Name: 2-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]ethyl 3-[(4-methylphenyl)sulfonylcarbamoylamino]benzoate Openeye Name: 2-(2,5-dioxopyrrolidin-1-yl)ethyl 3-(p-tolylsulfonylcarbamoylamino)benzoate CAS Name: 3-[[[(4-methylphenyl)sulfonylamino]-oxomethyl]amino]benzoic acid 2-(2,5-dioxo-1-pyrrolidinyl)ethyl ester IUPAC Name: 2-(2,5-dioxopyrrolidin-1-yl)ethyl 3-[(4-methylphenyl)sulfonylcarbamoylamino]benzoate Traditional Name: 3-(tosylcarbamoylamino)benzoic acid 2-succinimidoethyl ester Formula: C21H21N3O7S MolecularWeight: 459.47234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NC2=CC=CC(=C2)C(=O)OCCN3C(=O)CCC3=O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NC2=CC=CC(=C2)C(=O)OCCN3C(=O)CCC3=O

InChI

InChI=1S/C21H21N3O7S/c1-14-5-7-17(8-6-14)32(29,30)23-21(28)22-16-4-2-3-15(13-16)20(27)31-12-11-24-18(25)9-10-19(24)26/h2-8,13H,9-12H2,1H3,(H2,22,23,28)