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2-(3-bromophenyl)-6-(3-oxidanylpropylamino)benzo[de]isoquinoline-1,3-dione
2-(3-bromophenyl)-6-(3-oxidanylpropylamino)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)NCCCO)C=CC=C4C2=O
Isomeric SMILES
C1=CC(=CC(=C1)Br)N2C(=O)C3=C4C(=C(C=C3)NCCCO)C=CC=C4C2=O
InChI
InChI=1S/C21H17BrN2O3/c22-13-4-1-5-14(12-13)24-20(26)16-7-2-6-15-18(23-10-3-11-25)9-8-17(19(15)16)21(24)27/h1-2,4-9,12,23,25H,3,10-11H2
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