3-[5-bromanyl-1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]-4-methyl-benzoic acid

Systemtic Name: 3-[5-bromanyl-1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]-4-methyl-benzoic acid Openeye Name: 3-(5-bromo-1,3-dioxo-benzo[de]isoquinolin-2-yl)-4-methyl-benzoic acid CAS Name: 3-(5-bromo-1,3-dioxo-2-benzo[de]isoquinolinyl)-4-methylbenzoic acid IUPAC Name: 3-(5-bromo-1,3-dioxobenzo[de]isoquinolin-2-yl)-4-methylbenzoic acid Traditional Name: 3-(5-bromo-1,3-diketo-benzo[de]isoquinolin-2-yl)-4-methyl-benzoic acid Formula: C20H12BrNO4 MolecularWeight: 410.21758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)N2C(=O)C3=CC=CC4=CC(=CC(=C43)C2=O)Br

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)N2C(=O)C3=CC=CC4=CC(=CC(=C43)C2=O)Br

InChI

InChI=1S/C20H12BrNO4/c1-10-5-6-12(20(25)26)8-16(10)22-18(23)14-4-2-3-11-7-13(21)9-15(17(11)14)19(22)24/h2-9H,1H3,(H,25,26)