4-methyl-3-[6-nitro-1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]benzoic acid

Systemtic Name: 4-methyl-3-[6-nitro-1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]benzoic acid Openeye Name: 4-methyl-3-(6-nitro-1,3-dioxo-benzo[de]isoquinolin-2-yl)benzoic acid CAS Name: 4-methyl-3-(6-nitro-1,3-dioxo-2-benzo[de]isoquinolinyl)benzoic acid IUPAC Name: 4-methyl-3-(6-nitro-1,3-dioxobenzo[de]isoquinolin-2-yl)benzoic acid Traditional Name: 3-(1,3-diketo-6-nitro-benzo[de]isoquinolin-2-yl)-4-methyl-benzoic acid Formula: C20H12N2O6 MolecularWeight: 376.31908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)N2C(=O)C3=C4C(=C(C=C3)[N+](=O)[O-])C=CC=C4C2=O

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)N2C(=O)C3=C4C(=C(C=C3)[N+](=O)[O-])C=CC=C4C2=O

InChI

InChI=1S/C20H12N2O6/c1-10-5-6-11(20(25)26)9-16(10)21-18(23)13-4-2-3-12-15(22(27)28)8-7-14(17(12)13)19(21)24/h2-9H,1H3,(H,25,26)