1-cyclopropyl-7-(4-ethanoylpiperazin-1-yl)-6-fluoranyl-N-[(4-methylphenyl)methyl]-4-oxidanylidene-quinoline-3-carboxamide

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H29FN4O3/c1-17-3-5-19(6-4-17)15-29-27(35)22-16-32(20-7-8-20)24-14-25(23(28)13-21(24)26(22)34)31-11-9-30(10-12-31)18(2)33/h3-6,13-14,16,20H,7-12,15H2,1-2H3,(H,29,35)