2-(4-chlorophenyl)-6-nitro-quinoline-4-carboxylic acid

Systemtic Name: 2-(4-chlorophenyl)-6-nitro-quinoline-4-carboxylic acid Openeye Name: 2-(4-chlorophenyl)-6-nitro-quinoline-4-carboxylic acid CAS Name: 2-(4-chlorophenyl)-6-nitro-4-quinolinecarboxylic acid IUPAC Name: 2-(4-chlorophenyl)-6-nitroquinoline-4-carboxylic acid Traditional Name: 2-(4-chlorophenyl)-6-nitro-cinchoninic acid Formula: C16H9ClN2O4 MolecularWeight: 328.70666

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC3=C(C=C(C=C3)[N+](=O)[O-])C(=C2)C(=O)O)Cl

Isomeric SMILES

C1=CC(=CC=C1C2=NC3=C(C=C(C=C3)[N+](=O)[O-])C(=C2)C(=O)O)Cl

InChI

InChI=1S/C16H9ClN2O4/c17-10-3-1-9(2-4-10)15-8-13(16(20)21)12-7-11(19(22)23)5-6-14(12)18-15/h1-8H,(H,20,21)