ethyl 6-bromanyl-4-[(3,4-dimethylphenyl)amino]quinoline-3-carboxylate

Systemtic Name: ethyl 6-bromanyl-4-[(3,4-dimethylphenyl)amino]quinoline-3-carboxylate Openeye Name: ethyl 6-bromo-4-(3,4-dimethylanilino)quinoline-3-carboxylate CAS Name: 6-bromo-4-(3,4-dimethylanilino)-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-bromo-4-(3,4-dimethylanilino)quinoline-3-carboxylate Traditional Name: 6-bromo-4-(3,4-dimethylanilino)quinoline-3-carboxylic acid ethyl ester Formula: C20H19BrN2O2 MolecularWeight: 399.28106

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2C=CC(=CC2=C1NC3=CC(=C(C=C3)C)C)Br

Isomeric SMILES

CCOC(=O)C1=CN=C2C=CC(=CC2=C1NC3=CC(=C(C=C3)C)C)Br

InChI

InChI=1S/C20H19BrN2O2/c1-4-25-20(24)17-11-22-18-8-6-14(21)10-16(18)19(17)23-15-7-5-12(2)13(3)9-15/h5-11H,4H2,1-3H3,(H,22,23)