1-(4-bromophenyl)-6-nitro-4-oxidanylidene-cinnoline-3-carboxylic acid

Systemtic Name: 1-(4-bromophenyl)-6-nitro-4-oxidanylidene-cinnoline-3-carboxylic acid Openeye Name: 1-(4-bromophenyl)-6-nitro-4-oxo-cinnoline-3-carboxylic acid CAS Name: 1-(4-bromophenyl)-6-nitro-4-oxo-3-cinnolinecarboxylic acid IUPAC Name: 1-(4-bromophenyl)-6-nitro-4-oxocinnoline-3-carboxylic acid Traditional Name: 1-(4-bromophenyl)-4-keto-6-nitro-cinnoline-3-carboxylic acid Formula: C15H8BrN3O5 MolecularWeight: 390.14512

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C3=C(C=C(C=C3)[N+](=O)[O-])C(=O)C(=N2)C(=O)O)Br

Isomeric SMILES

C1=CC(=CC=C1N2C3=C(C=C(C=C3)[N+](=O)[O-])C(=O)C(=N2)C(=O)O)Br

InChI

InChI=1S/C15H8BrN3O5/c16-8-1-3-9(4-2-8)18-12-6-5-10(19(23)24)7-11(12)14(20)13(17-18)15(21)22/h1-7H,(H,21,22)