7-bromanyl-2-(2,4-dimethylphenyl)quinoline-4-carboxylate

Systemtic Name: 7-bromanyl-2-(2,4-dimethylphenyl)quinoline-4-carboxylate Openeye Name: 7-bromo-2-(2,4-dimethylphenyl)quinoline-4-carboxylate CAS Name: 7-bromo-2-(2,4-dimethylphenyl)-4-quinolinecarboxylate IUPAC Name: 7-bromo-2-(2,4-dimethylphenyl)quinoline-4-carboxylate Traditional Name: 7-bromo-2-(2,4-dimethylphenyl)cinchoninate Formula: C18H13BrNO2- MolecularWeight: 355.20532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=NC3=C(C=CC(=C3)Br)C(=C2)C(=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=NC3=C(C=CC(=C3)Br)C(=C2)C(=O)[O-])C

InChI

InChI=1S/C18H14BrNO2/c1-10-3-5-13(11(2)7-10)17-9-15(18(21)22)14-6-4-12(19)8-16(14)20-17/h3-9H,1-2H3,(H,21,22)/p-1