2-(4-bromanylphenoxy)ethyl 2-thiophen-2-ylquinoline-4-carboxylate

Systemtic Name: 2-(4-bromanylphenoxy)ethyl 2-thiophen-2-ylquinoline-4-carboxylate Openeye Name: 2-(4-bromophenoxy)ethyl 2-(2-thienyl)quinoline-4-carboxylate CAS Name: 2-thiophen-2-yl-4-quinolinecarboxylic acid 2-(4-bromophenoxy)ethyl ester IUPAC Name: 2-(4-bromophenoxy)ethyl 2-thiophen-2-ylquinoline-4-carboxylate Traditional Name: 2-(2-thienyl)cinchoninic acid 2-(4-bromophenoxy)ethyl ester Formula: C22H16BrNO3S MolecularWeight: 454.33634

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=CS3)C(=O)OCCOC4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=CS3)C(=O)OCCOC4=CC=C(C=C4)Br

InChI

InChI=1S/C22H16BrNO3S/c23-15-7-9-16(10-8-15)26-11-12-27-22(25)18-14-20(21-6-3-13-28-21)24-19-5-2-1-4-17(18)19/h1-10,13-14H,11-12H2