ethyl 6-azanyl-1-methyl-4-oxidanylidene-7-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]quinoline-3-carboxylate

Systemtic Name: ethyl 6-azanyl-1-methyl-4-oxidanylidene-7-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]quinoline-3-carboxylate Openeye Name: ethyl 6-amino-1-methyl-4-oxo-7-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]quinoline-3-carboxylate CAS Name: 6-amino-1-methyl-4-oxo-7-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-amino-1-methyl-4-oxo-7-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]quinoline-3-carboxylate Traditional Name: 6-amino-4-keto-1-methyl-7-[4-[3-(trifluoromethyl)phenyl]piperazino]quinoline-3-carboxylic acid ethyl ester Formula: C24H25F3N4O3 MolecularWeight: 474.47551

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C2=CC(=C(C=C2C1=O)N)N3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F)C

Isomeric SMILES

CCOC(=O)C1=CN(C2=CC(=C(C=C2C1=O)N)N3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F)C

InChI

InChI=1S/C24H25F3N4O3/c1-3-34-23(33)18-14-29(2)20-13-21(19(28)12-17(20)22(18)32)31-9-7-30(8-10-31)16-6-4-5-15(11-16)24(25,26)27/h4-6,11-14H,3,7-10,28H2,1-2H3