1-cyclopropyl-N-(2,4-dimethylphenyl)-7-(4-ethanoylpiperazin-1-yl)-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxamide

Systemtic Name: 1-cyclopropyl-N-(2,4-dimethylphenyl)-7-(4-ethanoylpiperazin-1-yl)-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxamide Openeye Name: 7-(4-acetylpiperazin-1-yl)-1-cyclopropyl-N-(2,4-dimethylphenyl)-6-fluoro-4-oxo-quinoline-3-carboxamide CAS Name: 7-(4-acetyl-1-piperazinyl)-1-cyclopropyl-N-(2,4-dimethylphenyl)-6-fluoro-4-oxo-3-quinolinecarboxamide IUPAC Name: 7-(4-acetylpiperazin-1-yl)-1-cyclopropyl-N-(2,4-dimethylphenyl)-6-fluoro-4-oxoquinoline-3-carboxamide Traditional Name: 7-(4-acetylpiperazino)-1-cyclopropyl-N-(2,4-dimethylphenyl)-6-fluoro-4-keto-quinoline-3-carboxamide Formula: C27H29FN4O3 MolecularWeight: 476.542563

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2=CN(C3=CC(=C(C=C3C2=O)F)N4CCN(CC4)C(=O)C)C5CC5)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2=CN(C3=CC(=C(C=C3C2=O)F)N4CCN(CC4)C(=O)C)C5CC5)C

InChI

InChI=1S/C27H29FN4O3/c1-16-4-7-23(17(2)12-16)29-27(35)21-15-32(19-5-6-19)24-14-25(22(28)13-20(24)26(21)34)31-10-8-30(9-11-31)18(3)33/h4,7,12-15,19H,5-6,8-11H2,1-3H3,(H,29,35)