3-[1,3-bis(oxidanylidene)isoindol-2-yl]propyl 4-[(4-methylphenyl)sulfonylcarbamoylamino]benzoate

Systemtic Name: 3-[1,3-bis(oxidanylidene)isoindol-2-yl]propyl 4-[(4-methylphenyl)sulfonylcarbamoylamino]benzoate Openeye Name: 3-(1,3-dioxoisoindolin-2-yl)propyl 4-(p-tolylsulfonylcarbamoylamino)benzoate CAS Name: 4-[[[(4-methylphenyl)sulfonylamino]-oxomethyl]amino]benzoic acid 3-(1,3-dioxo-2-isoindolyl)propyl ester IUPAC Name: 3-(1,3-dioxoisoindol-2-yl)propyl 4-[(4-methylphenyl)sulfonylcarbamoylamino]benzoate Traditional Name: 4-(tosylcarbamoylamino)benzoic acid 3-phthalimidopropyl ester Formula: C26H23N3O7S MolecularWeight: 521.54172

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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)OCCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NC2=CC=C(C=C2)C(=O)OCCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C26H23N3O7S/c1-17-7-13-20(14-8-17)37(34,35)28-26(33)27-19-11-9-18(10-12-19)25(32)36-16-4-15-29-23(30)21-5-2-3-6-22(21)24(29)31/h2-3,5-14H,4,15-16H2,1H3,(H2,27,28,33)