sodium 2-(4-aminophenyl)quinoline-4-carboxylate

Systemtic Name: sodium 2-(4-aminophenyl)quinoline-4-carboxylate Openeye Name: sodium 2-(4-aminophenyl)quinoline-4-carboxylate CAS Name: sodium 2-(4-aminophenyl)-4-quinolinecarboxylate IUPAC Name: sodium 2-(4-aminophenyl)quinoline-4-carboxylate Traditional Name: sodium 2-(4-aminophenyl)cinchoninate Formula: C16H11N2NaO2 MolecularWeight: 286.26051

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=C(C=C3)N)C(=O)[O-].[Na+]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=C(C=C3)N)C(=O)[O-].[Na+]

InChI

InChI=1S/C16H12N2O2.Na/c17-11-7-5-10(6-8-11)15-9-13(16(19)20)12-3-1-2-4-14(12)18-15;/h1-9H,17H2,(H,19,20);/q;+1/p-1