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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)C2=CN(C3=CC(=C(C=C3C2=O)F)N4CCN(CC4)C(=O)C)C5CC5

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)C2=CN(C3=CC(=C(C=C3C2=O)F)N4CCN(CC4)C(=O)C)C5CC5

InChI

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