2-[5-(2-bromophenyl)furan-2-yl]quinoline-4-carboxylate

Systemtic Name: 2-[5-(2-bromophenyl)furan-2-yl]quinoline-4-carboxylate Openeye Name: 2-[5-(2-bromophenyl)-2-furyl]quinoline-4-carboxylate CAS Name: 2-[5-(2-bromophenyl)-2-furanyl]-4-quinolinecarboxylate IUPAC Name: 2-[5-(2-bromophenyl)furan-2-yl]quinoline-4-carboxylate Traditional Name: 2-[5-(2-bromophenyl)-2-furyl]cinchoninate Formula: C20H11BrNO3- MolecularWeight: 393.21024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=C(O3)C4=CC=CC=C4Br)C(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=C(O3)C4=CC=CC=C4Br)C(=O)[O-]

InChI

InChI=1S/C20H12BrNO3/c21-15-7-3-1-6-13(15)18-9-10-19(25-18)17-11-14(20(23)24)12-5-2-4-8-16(12)22-17/h1-11H,(H,23,24)/p-1