N-dodecyl-1-ethyl-6-fluoranyl-7-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-4-oxidanylidene-quinoline-3-carboxamide

Systemtic Name: N-dodecyl-1-ethyl-6-fluoranyl-7-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-4-oxidanylidene-quinoline-3-carboxamide Openeye Name: N-dodecyl-1-ethyl-6-fluoro-7-[4-(furan-2-carbonyl)piperazin-1-yl]-4-oxo-quinoline-3-carboxamide CAS Name: N-dodecyl-1-ethyl-6-fluoro-7-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-4-oxo-3-quinolinecarboxamide IUPAC Name: N-dodecyl-1-ethyl-6-fluoro-7-[4-(furan-2-carbonyl)piperazin-1-yl]-4-oxoquinoline-3-carboxamide Traditional Name: 1-ethyl-6-fluoro-7-[4-(2-furoyl)piperazino]-4-keto-N-lauryl-quinoline-3-carboxamide Formula: C33H45FN4O4 MolecularWeight: 580.733203

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCNC(=O)C1=CN(C2=CC(=C(C=C2C1=O)F)N3CCN(CC3)C(=O)C4=CC=CO4)CC

Isomeric SMILES

CCCCCCCCCCCCNC(=O)C1=CN(C2=CC(=C(C=C2C1=O)F)N3CCN(CC3)C(=O)C4=CC=CO4)CC

InChI

InChI=1S/C33H45FN4O4/c1-3-5-6-7-8-9-10-11-12-13-16-35-32(40)26-24-36(4-2)28-23-29(27(34)22-25(28)31(26)39)37-17-19-38(20-18-37)33(41)30-15-14-21-42-30/h14-15,21-24H,3-13,16-20H2,1-2H3,(H,35,40)