[2-(4-bromophenyl)-2-oxidanylidene-ethyl] 2,8-dimethylquinoline-4-carboxylate

Systemtic Name: [2-(4-bromophenyl)-2-oxidanylidene-ethyl] 2,8-dimethylquinoline-4-carboxylate Openeye Name: [2-(4-bromophenyl)-2-oxo-ethyl] 2,8-dimethylquinoline-4-carboxylate CAS Name: 2,8-dimethyl-4-quinolinecarboxylic acid [2-(4-bromophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-bromophenyl)-2-oxoethyl] 2,8-dimethylquinoline-4-carboxylate Traditional Name: 2,8-dimethylcinchoninic acid [2-(4-bromophenyl)-2-keto-ethyl] ester Formula: C20H16BrNO3 MolecularWeight: 398.24994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2C(=O)OCC(=O)C3=CC=C(C=C3)Br)C

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C(=O)OCC(=O)C3=CC=C(C=C3)Br)C

InChI

InChI=1S/C20H16BrNO3/c1-12-4-3-5-16-17(10-13(2)22-19(12)16)20(24)25-11-18(23)14-6-8-15(21)9-7-14/h3-10H,11H2,1-2H3