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2-(3-bromophenyl)-6-(2-hydroxyethylsulfanyl)benzo[de]isoquinoline-1,3-dione
2-(3-bromophenyl)-6-(2-hydroxyethylsulfanyl)benzo[de]isoquinoline-1,3-dione
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Descriptors Computed from Structure
Canonical SMILES:
C1=CC(=CC(=C1)Br)N2C(=O)C3=C4C(=C(C=C3)SCCO)C=CC=C4C2=O
Isomeric SMILES
C1=CC(=CC(=C1)Br)N2C(=O)C3=C4C(=C(C=C3)SCCO)C=CC=C4C2=O
InChI
InChI=1S/C20H14BrNO3S/c21-12-3-1-4-13(11-12)22-19(24)15-6-2-5-14-17(26-10-9-23)8-7-16(18(14)15)20(22)25/h1-8,11,23H,9-10H2
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