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

Systemtic Name: ethyl 7,8-bis(chloranyl)-4-[(4-propan-2-yloxycarbonylphenyl)amino]quinoline-3-carboxylate Openeye Name: ethyl 7,8-dichloro-4-(4-isopropoxycarbonylanilino)quinoline-3-carboxylate CAS Name: 7,8-dichloro-4-[4-[oxo(propan-2-yloxy)methyl]anilino]-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 7,8-dichloro-4-(4-propan-2-yloxycarbonylanilino)quinoline-3-carboxylate Traditional Name: 7,8-dichloro-4-(4-isopropoxycarbonylanilino)quinoline-3-carboxylic acid ethyl ester Formula: C22H20Cl2N2O4 MolecularWeight: 447.3112

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H20Cl2N2O4/c1-4-29-22(28)16-11-25-20-15(9-10-17(23)18(20)24)19(16)26-14-7-5-13(6-8-14)21(27)30-12(2)3/h5-12H,4H2,1-3H3,(H,25,26)