2-(3-bromanylphenoxy)ethyl 2-(5-chloranylthiophen-2-yl)quinoline-4-carboxylate

Systemtic Name: 2-(3-bromanylphenoxy)ethyl 2-(5-chloranylthiophen-2-yl)quinoline-4-carboxylate Openeye Name: 2-(3-bromophenoxy)ethyl 2-(5-chloro-2-thienyl)quinoline-4-carboxylate CAS Name: 2-(5-chloro-2-thiophenyl)-4-quinolinecarboxylic acid 2-(3-bromophenoxy)ethyl ester IUPAC Name: 2-(3-bromophenoxy)ethyl 2-(5-chlorothiophen-2-yl)quinoline-4-carboxylate Traditional Name: 2-(5-chloro-2-thienyl)cinchoninic acid 2-(3-bromophenoxy)ethyl ester Formula: C22H15BrClNO3S MolecularWeight: 488.7814

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=C(S3)Cl)C(=O)OCCOC4=CC(=CC=C4)Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=C(S3)Cl)C(=O)OCCOC4=CC(=CC=C4)Br

InChI

InChI=1S/C22H15BrClNO3S/c23-14-4-3-5-15(12-14)27-10-11-28-22(26)17-13-19(20-8-9-21(24)29-20)25-18-7-2-1-6-16(17)18/h1-9,12-13H,10-11H2