N-(1,3-benzodioxol-5-yl)-7-(4-ethanoylpiperazin-1-yl)-1-ethyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-7-(4-ethanoylpiperazin-1-yl)-1-ethyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxamide Openeye Name: 7-(4-acetylpiperazin-1-yl)-N-(1,3-benzodioxol-5-yl)-1-ethyl-6-fluoro-4-oxo-quinoline-3-carboxamide CAS Name: 7-(4-acetyl-1-piperazinyl)-N-(1,3-benzodioxol-5-yl)-1-ethyl-6-fluoro-4-oxo-3-quinolinecarboxamide IUPAC Name: 7-(4-acetylpiperazin-1-yl)-N-(1,3-benzodioxol-5-yl)-1-ethyl-6-fluoro-4-oxoquinoline-3-carboxamide Traditional Name: 7-(4-acetylpiperazino)-N-(1,3-benzodioxol-5-yl)-1-ethyl-6-fluoro-4-keto-quinoline-3-carboxamide Formula: C25H25FN4O5 MolecularWeight: 480.488203

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C(=O)C)F)C(=O)NC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C(=O)C)F)C(=O)NC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C25H25FN4O5/c1-3-28-13-18(25(33)27-16-4-5-22-23(10-16)35-14-34-22)24(32)17-11-19(26)21(12-20(17)28)30-8-6-29(7-9-30)15(2)31/h4-5,10-13H,3,6-9,14H2,1-2H3,(H,27,33)