6-bromanyl-2-(5-methyl-1-phenyl-1,2,3-triazol-4-yl)quinoline-4-carboxylate

Systemtic Name: 6-bromanyl-2-(5-methyl-1-phenyl-1,2,3-triazol-4-yl)quinoline-4-carboxylate Openeye Name: 6-bromo-2-(5-methyl-1-phenyl-triazol-4-yl)quinoline-4-carboxylate CAS Name: 6-bromo-2-(5-methyl-1-phenyl-4-triazolyl)-4-quinolinecarboxylate IUPAC Name: 6-bromo-2-(5-methyl-1-phenyltriazol-4-yl)quinoline-4-carboxylate Traditional Name: 6-bromo-2-(5-methyl-1-phenyl-triazol-4-yl)cinchoninate Formula: C19H12BrN4O2- MolecularWeight: 408.22818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=NN1C2=CC=CC=C2)C3=NC4=C(C=C(C=C4)Br)C(=C3)C(=O)[O-]

Isomeric SMILES

CC1=C(N=NN1C2=CC=CC=C2)C3=NC4=C(C=C(C=C4)Br)C(=C3)C(=O)[O-]

InChI

InChI=1S/C19H13BrN4O2/c1-11-18(22-23-24(11)13-5-3-2-4-6-13)17-10-15(19(25)26)14-9-12(20)7-8-16(14)21-17/h2-10H,1H3,(H,25,26)/p-1