2-[(4-methylphenyl)sulfonylamino]ethyl 2-butyl-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: 2-[(4-methylphenyl)sulfonylamino]ethyl 2-butyl-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: 2-(p-tolylsulfonylamino)ethyl 2-butyl-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-butyl-1,3-dioxo-5-isoindolecarboxylic acid 2-[(4-methylphenyl)sulfonylamino]ethyl ester IUPAC Name: 2-[(4-methylphenyl)sulfonylamino]ethyl 2-butyl-1,3-dioxoisoindole-5-carboxylate Traditional Name: 2-butyl-1,3-diketo-isoindoline-5-carboxylic acid 2-(tosylamino)ethyl ester Formula: C22H24N2O6S MolecularWeight: 444.50076

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)OCCNS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)OCCNS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C22H24N2O6S/c1-3-4-12-24-20(25)18-10-7-16(14-19(18)21(24)26)22(27)30-13-11-23-31(28,29)17-8-5-15(2)6-9-17/h5-10,14,23H,3-4,11-13H2,1-2H3