[1-(aminocarbonylamino)-1-oxidanylidene-propan-2-yl] 6-bromanyl-2-phenyl-quinoline-4-carboxylate

Systemtic Name: [1-(aminocarbonylamino)-1-oxidanylidene-propan-2-yl] 6-bromanyl-2-phenyl-quinoline-4-carboxylate Openeye Name: (1-methyl-2-oxo-2-ureido-ethyl) 6-bromo-2-phenyl-quinoline-4-carboxylate CAS Name: 6-bromo-2-phenyl-4-quinolinecarboxylic acid [1-(carbamoylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(carbamoylamino)-1-oxopropan-2-yl] 6-bromo-2-phenylquinoline-4-carboxylate Traditional Name: 6-bromo-2-phenyl-cinchoninic acid (2-keto-1-methyl-2-ureido-ethyl) ester Formula: C20H16BrN3O4 MolecularWeight: 442.26274

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)N)OC(=O)C1=CC(=NC2=C1C=C(C=C2)Br)C3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NC(=O)N)OC(=O)C1=CC(=NC2=C1C=C(C=C2)Br)C3=CC=CC=C3

InChI

InChI=1S/C20H16BrN3O4/c1-11(18(25)24-20(22)27)28-19(26)15-10-17(12-5-3-2-4-6-12)23-16-8-7-13(21)9-14(15)16/h2-11H,1H3,(H3,22,24,25,27)