2-[(2R)-1-(benzotriazol-1-yl)-4-methylsulfonyl-1-oxidanylidene-butan-2-yl]isoindole-1,3-dione

Systemtic Name: 2-[(2R)-1-(benzotriazol-1-yl)-4-methylsulfonyl-1-oxidanylidene-butan-2-yl]isoindole-1,3-dione Openeye Name: 2-[(1R)-1-(benzotriazole-1-carbonyl)-3-methylsulfonyl-propyl]isoindoline-1,3-dione CAS Name: 2-[(2R)-1-(1-benzotriazolyl)-4-methylsulfonyl-1-oxobutan-2-yl]isoindole-1,3-dione IUPAC Name: 2-[(2R)-1-(benzotriazol-1-yl)-4-methylsulfonyl-1-oxobutan-2-yl]isoindole-1,3-dione Traditional Name: 2-[(1R)-1-(benzotriazole-1-carbonyl)-3-mesyl-propyl]isoindoline-1,3-quinone Formula: C19H16N4O5S MolecularWeight: 412.41914

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCC(C(=O)N1C2=CC=CC=C2N=N1)N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CS(=O)(=O)CC[C@H](C(=O)N1C2=CC=CC=C2N=N1)N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C19H16N4O5S/c1-29(27,28)11-10-16(19(26)23-15-9-5-4-8-14(15)20-21-23)22-17(24)12-6-2-3-7-13(12)18(22)25/h2-9,16H,10-11H2,1H3/t16-/m1/s1