(3E)-6-bromanyl-3-(phenylmethylidene)-2-propan-2-ylsulfonyl-1H-isoindol-5-ol

Systemtic Name: (3E)-6-bromanyl-3-(phenylmethylidene)-2-propan-2-ylsulfonyl-1H-isoindol-5-ol Openeye Name: (3E)-3-benzylidene-6-bromo-2-isopropylsulfonyl-isoindolin-5-ol CAS Name: (3E)-6-bromo-3-(phenylmethylene)-2-propan-2-ylsulfonyl-1H-isoindol-5-ol IUPAC Name: (3E)-3-benzylidene-6-bromo-2-propan-2-ylsulfonyl-1H-isoindol-5-ol Traditional Name: (3E)-3-benzal-6-bromo-2-isopropylsulfonyl-isoindolin-5-ol Formula: C18H18BrNO3S MolecularWeight: 408.30942

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)N1CC2=CC(=C(C=C2C1=CC3=CC=CC=C3)O)Br

Isomeric SMILES

CC(C)S(=O)(=O)N\1CC2=CC(=C(C=C2/C1=C\C3=CC=CC=C3)O)Br

InChI

InChI=1S/C18H18BrNO3S/c1-12(2)24(22,23)20-11-14-9-16(19)18(21)10-15(14)17(20)8-13-6-4-3-5-7-13/h3-10,12,21H,11H2,1-2H3/b17-8+