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

Systemtic Name: ethyl 4-[(4-acetamidophenyl)amino]-6-bromanyl-quinoline-3-carboxylate Openeye Name: ethyl 4-(4-acetamidoanilino)-6-bromo-quinoline-3-carboxylate CAS Name: 4-(4-acetamidoanilino)-6-bromo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-acetamidoanilino)-6-bromoquinoline-3-carboxylate Traditional Name: 4-(4-acetamidoanilino)-6-bromo-quinoline-3-carboxylic acid ethyl ester Formula: C20H18BrN3O3 MolecularWeight: 428.27922

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18BrN3O3/c1-3-27-20(26)17-11-22-18-9-4-13(21)10-16(18)19(17)24-15-7-5-14(6-8-15)23-12(2)25/h4-11H,3H2,1-2H3,(H,22,24)(H,23,25)