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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-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-ylmethyl)-1-ethyl-6-fluoro-4-oxo-quinoline-3-carboxamide CAS Name: 7-(4-acetyl-1-piperazinyl)-N-(1,3-benzodioxol-5-ylmethyl)-1-ethyl-6-fluoro-4-oxo-3-quinolinecarboxamide IUPAC Name: 7-(4-acetylpiperazin-1-yl)-N-(1,3-benzodioxol-5-ylmethyl)-1-ethyl-6-fluoro-4-oxoquinoline-3-carboxamide Traditional Name: 7-(4-acetylpiperazino)-1-ethyl-6-fluoro-4-keto-N-piperonyl-quinoline-3-carboxamide Formula: C26H27FN4O5 MolecularWeight: 494.514783

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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)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C(=O)C)F)C(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C26H27FN4O5/c1-3-29-14-19(26(34)28-13-17-4-5-23-24(10-17)36-15-35-23)25(33)18-11-20(27)22(12-21(18)29)31-8-6-30(7-9-31)16(2)32/h4-5,10-12,14H,3,6-9,13,15H2,1-2H3,(H,28,34)