ethyl 1-[(4-fluorophenyl)methyl]-4-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-6-methyl-2-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: ethyl 1-[(4-fluorophenyl)methyl]-4-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-6-methyl-2-oxidanylidene-quinoline-3-carboxylate Openeye Name: ethyl 1-[(4-fluorophenyl)methyl]-4-[4-(furan-2-carbonyl)piperazin-1-yl]-6-methyl-2-oxo-quinoline-3-carboxylate CAS Name: 1-[(4-fluorophenyl)methyl]-4-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-6-methyl-2-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(4-fluorophenyl)methyl]-4-[4-(furan-2-carbonyl)piperazin-1-yl]-6-methyl-2-oxoquinoline-3-carboxylate Traditional Name: 1-(4-fluorobenzyl)-4-[4-(2-furoyl)piperazino]-2-keto-6-methyl-quinoline-3-carboxylic acid ethyl ester Formula: C29H28FN3O5 MolecularWeight: 517.548123

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C=CC(=C2)C)N(C1=O)CC3=CC=C(C=C3)F)N4CCN(CC4)C(=O)C5=CC=CO5

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C=CC(=C2)C)N(C1=O)CC3=CC=C(C=C3)F)N4CCN(CC4)C(=O)C5=CC=CO5

InChI

InChI=1S/C29H28FN3O5/c1-3-37-29(36)25-26(31-12-14-32(15-13-31)27(34)24-5-4-16-38-24)22-17-19(2)6-11-23(22)33(28(25)35)18-20-7-9-21(30)10-8-20/h4-11,16-17H,3,12-15,18H2,1-2H3