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

Systemtic Name: ethyl 6-bromanyl-4-[(3-ethoxycarbonylphenyl)amino]quinoline-3-carboxylate Openeye Name: ethyl 6-bromo-4-(3-ethoxycarbonylanilino)quinoline-3-carboxylate CAS Name: 6-bromo-4-(3-ethoxycarbonylanilino)-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-bromo-4-(3-ethoxycarbonylanilino)quinoline-3-carboxylate Traditional Name: 6-bromo-4-(3-carbethoxyanilino)quinoline-3-carboxylic acid ethyl ester Formula: C21H19BrN2O4 MolecularWeight: 443.29056

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC2=C3C=C(C=CC3=NC=C2C(=O)OCC)Br

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC2=C3C=C(C=CC3=NC=C2C(=O)OCC)Br

InChI

InChI=1S/C21H19BrN2O4/c1-3-27-20(25)13-6-5-7-15(10-13)24-19-16-11-14(22)8-9-18(16)23-12-17(19)21(26)28-4-2/h5-12H,3-4H2,1-2H3,(H,23,24)