3-[6-bromanyl-1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]propanoic acid

Systemtic Name: 3-[6-bromanyl-1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]propanoic acid Openeye Name: 3-(6-bromo-1,3-dioxo-benzo[de]isoquinolin-2-yl)propanoic acid CAS Name: 3-(6-bromo-1,3-dioxo-2-benzo[de]isoquinolinyl)propanoic acid IUPAC Name: 3-(6-bromo-1,3-dioxobenzo[de]isoquinolin-2-yl)propanoic acid Traditional Name: 3-(6-bromo-1,3-diketo-benzo[de]isoquinolin-2-yl)propionic acid Formula: C15H10BrNO4 MolecularWeight: 348.1482

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC3=C2C(=C1)C(=O)N(C3=O)CCC(=O)O)Br

Isomeric SMILES

C1=CC2=C(C=CC3=C2C(=C1)C(=O)N(C3=O)CCC(=O)O)Br

InChI

InChI=1S/C15H10BrNO4/c16-11-5-4-10-13-8(11)2-1-3-9(13)14(20)17(15(10)21)7-6-12(18)19/h1-5H,6-7H2,(H,18,19)