2-oxidanylidenepropyl 2-(3-bromanyl-4-methoxy-phenyl)quinoline-4-carboxylate

Systemtic Name: 2-oxidanylidenepropyl 2-(3-bromanyl-4-methoxy-phenyl)quinoline-4-carboxylate Openeye Name: acetonyl 2-(3-bromo-4-methoxy-phenyl)quinoline-4-carboxylate CAS Name: 2-(3-bromo-4-methoxyphenyl)-4-quinolinecarboxylic acid 2-oxopropyl ester IUPAC Name: 2-oxopropyl 2-(3-bromo-4-methoxyphenyl)quinoline-4-carboxylate Traditional Name: 2-(3-bromo-4-methoxy-phenyl)cinchoninic acid acetonyl ester Formula: C20H16BrNO4 MolecularWeight: 414.24934

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)COC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC(=C(C=C3)OC)Br

Isomeric SMILES

CC(=O)COC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC(=C(C=C3)OC)Br

InChI

InChI=1S/C20H16BrNO4/c1-12(23)11-26-20(24)15-10-18(22-17-6-4-3-5-14(15)17)13-7-8-19(25-2)16(21)9-13/h3-10H,11H2,1-2H3