8-bromanyl-6-methyl-2-(4-methylphenyl)quinoline-4-carboxylate

Systemtic Name: 8-bromanyl-6-methyl-2-(4-methylphenyl)quinoline-4-carboxylate Openeye Name: 8-bromo-6-methyl-2-(p-tolyl)quinoline-4-carboxylate CAS Name: 8-bromo-6-methyl-2-(4-methylphenyl)-4-quinolinecarboxylate IUPAC Name: 8-bromo-6-methyl-2-(4-methylphenyl)quinoline-4-carboxylate Traditional Name: 8-bromo-6-methyl-2-(p-tolyl)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=C(C=C3C(=C2)C(=O)[O-])C)Br

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3C(=C2)C(=O)[O-])C)Br

InChI

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