(3Z)-2-bromanyl-3-(phenylmethylidene)-5,6-bis(propan-2-ylsulfonyl)-1H-isoindole

Systemtic Name: (3Z)-2-bromanyl-3-(phenylmethylidene)-5,6-bis(propan-2-ylsulfonyl)-1H-isoindole Openeye Name: (1Z)-1-benzylidene-2-bromo-5,6-bis(isopropylsulfonyl)isoindoline CAS Name: (3Z)-2-bromo-3-(phenylmethylene)-5,6-bis(propan-2-ylsulfonyl)-1H-isoindole IUPAC Name: (3Z)-3-benzylidene-2-bromo-5,6-bis(propan-2-ylsulfonyl)-1H-isoindole Traditional Name: (1Z)-1-benzal-2-bromo-5,6-bis(isopropylsulfonyl)isoindoline Formula: C21H24BrNO4S2 MolecularWeight: 498.45356

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=C(C=C2C(=C1)CN(C2=CC3=CC=CC=C3)Br)S(=O)(=O)C(C)C

Isomeric SMILES

CC(C)S(=O)(=O)C1=C(C=C\2C(=C1)CN(/C2=C\C3=CC=CC=C3)Br)S(=O)(=O)C(C)C

InChI

InChI=1S/C21H24BrNO4S2/c1-14(2)28(24,25)20-11-17-13-23(22)19(10-16-8-6-5-7-9-16)18(17)12-21(20)29(26,27)15(3)4/h5-12,14-15H,13H2,1-4H3/b19-10-