ethyl 4-[3-[(3-chloranyl-4-fluoranyl-phenoxy)methyl]-4-methoxy-phenyl]-2-methyl-5-oxidanylidene-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate

Systemtic Name: ethyl 4-[3-[(3-chloranyl-4-fluoranyl-phenoxy)methyl]-4-methoxy-phenyl]-2-methyl-5-oxidanylidene-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate Openeye Name: ethyl 4-[3-[(3-chloro-4-fluoro-phenoxy)methyl]-4-methoxy-phenyl]-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate CAS Name: 4-[3-[(3-chloro-4-fluorophenoxy)methyl]-4-methoxyphenyl]-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-[(3-chloro-4-fluorophenoxy)methyl]-4-methoxyphenyl]-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate Traditional Name: 4-[3-[(3-chloro-4-fluoro-phenoxy)methyl]-4-methoxy-phenyl]-5-keto-2-methyl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid ethyl ester Formula: C27H27ClFNO5 MolecularWeight: 499.958383

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC2=C(C1C3=CC(=C(C=C3)OC)COC4=CC(=C(C=C4)F)Cl)C(=O)CCC2)C

Isomeric SMILES

CCOC(=O)C1=C(NC2=C(C1C3=CC(=C(C=C3)OC)COC4=CC(=C(C=C4)F)Cl)C(=O)CCC2)C

InChI

InChI=1S/C27H27ClFNO5/c1-4-34-27(32)24-15(2)30-21-6-5-7-22(31)26(21)25(24)16-8-11-23(33-3)17(12-16)14-35-18-9-10-20(29)19(28)13-18/h8-13,25,30H,4-7,14H2,1-3H3