8-bromanyl-3,6-dimethyl-2-phenyl-quinoline-4-carboxylate

Systemtic Name: 8-bromanyl-3,6-dimethyl-2-phenyl-quinoline-4-carboxylate Openeye Name: 8-bromo-3,6-dimethyl-2-phenyl-quinoline-4-carboxylate CAS Name: 8-bromo-3,6-dimethyl-2-phenyl-4-quinolinecarboxylate IUPAC Name: 8-bromo-3,6-dimethyl-2-phenylquinoline-4-carboxylate Traditional Name: 8-bromo-3,6-dimethyl-2-phenyl-cinchoninate Formula: C18H13BrNO2- MolecularWeight: 355.20532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=C(C(=N2)C3=CC=CC=C3)C)C(=O)[O-])Br

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=C(C(=N2)C3=CC=CC=C3)C)C(=O)[O-])Br

InChI

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