ethyl 4-[4-[[1,3-bis(oxidanylidene)isoindol-5-yl]carbamoyl]phenyl]sulfonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[4-[[1,3-bis(oxidanylidene)isoindol-5-yl]carbamoyl]phenyl]sulfonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[4-[(1,3-dioxoisoindolin-5-yl)carbamoyl]phenyl]sulfonylpiperazine-1-carboxylate CAS Name: 4-[4-[[(1,3-dioxo-5-isoindolyl)amino]-oxomethyl]phenyl]sulfonyl-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-[(1,3-dioxoisoindol-5-yl)carbamoyl]phenyl]sulfonylpiperazine-1-carboxylate Traditional Name: 4-[4-[(1,3-diketoisoindolin-5-yl)carbamoyl]phenyl]sulfonylpiperazine-1-carboxylic acid ethyl ester Formula: C22H22N4O7S MolecularWeight: 486.49768

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=CC4=C(C=C3)C(=O)NC4=O

Isomeric SMILES

CCOC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=CC4=C(C=C3)C(=O)NC4=O

InChI

InChI=1S/C22H22N4O7S/c1-2-33-22(30)25-9-11-26(12-10-25)34(31,32)16-6-3-14(4-7-16)19(27)23-15-5-8-17-18(13-15)21(29)24-20(17)28/h3-8,13H,2,9-12H2,1H3,(H,23,27)(H,24,28,29)