ethyl 7,8-bis(chloranyl)-4-[(4-propan-2-yloxyphenyl)amino]quinoline-3-carboxylate

Systemtic Name: ethyl 7,8-bis(chloranyl)-4-[(4-propan-2-yloxyphenyl)amino]quinoline-3-carboxylate Openeye Name: ethyl 7,8-dichloro-4-(4-isopropoxyanilino)quinoline-3-carboxylate CAS Name: 7,8-dichloro-4-(4-propan-2-yloxyanilino)-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 7,8-dichloro-4-(4-propan-2-yloxyanilino)quinoline-3-carboxylate Traditional Name: 7,8-dichloro-4-(4-isopropoxyanilino)quinoline-3-carboxylic acid ethyl ester Formula: C21H20Cl2N2O3 MolecularWeight: 419.3011

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2C(=C1NC3=CC=C(C=C3)OC(C)C)C=CC(=C2Cl)Cl

Isomeric SMILES

CCOC(=O)C1=CN=C2C(=C1NC3=CC=C(C=C3)OC(C)C)C=CC(=C2Cl)Cl

InChI

InChI=1S/C21H20Cl2N2O3/c1-4-27-21(26)16-11-24-20-15(9-10-17(22)18(20)23)19(16)25-13-5-7-14(8-6-13)28-12(2)3/h5-12H,4H2,1-3H3,(H,24,25)