2-(4-bromanylphenoxy)ethyl 2-ethyl-3-methyl-quinoline-4-carboxylate

Systemtic Name: 2-(4-bromanylphenoxy)ethyl 2-ethyl-3-methyl-quinoline-4-carboxylate Openeye Name: 2-(4-bromophenoxy)ethyl 2-ethyl-3-methyl-quinoline-4-carboxylate CAS Name: 2-ethyl-3-methyl-4-quinolinecarboxylic acid 2-(4-bromophenoxy)ethyl ester IUPAC Name: 2-(4-bromophenoxy)ethyl 2-ethyl-3-methylquinoline-4-carboxylate Traditional Name: 2-ethyl-3-methyl-cinchoninic acid 2-(4-bromophenoxy)ethyl ester Formula: C21H20BrNO3 MolecularWeight: 414.2924

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC=CC=C2C(=C1C)C(=O)OCCOC3=CC=C(C=C3)Br

Isomeric SMILES

CCC1=NC2=CC=CC=C2C(=C1C)C(=O)OCCOC3=CC=C(C=C3)Br

InChI

InChI=1S/C21H20BrNO3/c1-3-18-14(2)20(17-6-4-5-7-19(17)23-18)21(24)26-13-12-25-16-10-8-15(22)9-11-16/h4-11H,3,12-13H2,1-2H3