(4-chlorophenyl)methyl 1-[(4-chlorophenyl)methyl]-6-fluoranyl-4-oxidanylidene-7-piperazin-1-yl-quinoline-3-carboxylate

Systemtic Name: (4-chlorophenyl)methyl 1-[(4-chlorophenyl)methyl]-6-fluoranyl-4-oxidanylidene-7-piperazin-1-yl-quinoline-3-carboxylate Openeye Name: (4-chlorophenyl)methyl 1-[(4-chlorophenyl)methyl]-6-fluoro-4-oxo-7-piperazin-1-yl-quinoline-3-carboxylate CAS Name: 1-[(4-chlorophenyl)methyl]-6-fluoro-4-oxo-7-(1-piperazinyl)-3-quinolinecarboxylic acid (4-chlorophenyl)methyl ester IUPAC Name: (4-chlorophenyl)methyl 1-[(4-chlorophenyl)methyl]-6-fluoro-4-oxo-7-piperazin-1-ylquinoline-3-carboxylate Traditional Name: 1-(4-chlorobenzyl)-6-fluoro-4-keto-7-piperazino-quinoline-3-carboxylic acid (4-chlorobenzyl) ester Formula: C28H24Cl2FN3O3 MolecularWeight: 540.412863

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)OCC4=CC=C(C=C4)Cl)CC5=CC=C(C=C5)Cl)F

Isomeric SMILES

C1CN(CCN1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)OCC4=CC=C(C=C4)Cl)CC5=CC=C(C=C5)Cl)F

InChI

InChI=1S/C28H24Cl2FN3O3/c29-20-5-1-18(2-6-20)15-34-16-23(28(36)37-17-19-3-7-21(30)8-4-19)27(35)22-13-24(31)26(14-25(22)34)33-11-9-32-10-12-33/h1-8,13-14,16,32H,9-12,15,17H2