ethyl 5-[[5-ethoxycarbonyl-6-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxidanyl-4-oxidanylidene-1H-pyridin-3-yl]-(4-fluorophenyl)methyl]-2-[4-(4-methoxyphenyl)piperazin-1-yl]-6-oxidanyl-4-oxidanylidene-1H-pyridine-3-carboxylate

Systemtic Name: ethyl 5-[[5-ethoxycarbonyl-6-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxidanyl-4-oxidanylidene-1H-pyridin-3-yl]-(4-fluorophenyl)methyl]-2-[4-(4-methoxyphenyl)piperazin-1-yl]-6-oxidanyl-4-oxidanylidene-1H-pyridine-3-carboxylate Openeye Name: ethyl 5-[[5-ethoxycarbonyl-2-hydroxy-6-[4-(4-methoxyphenyl)piperazin-1-yl]-4-oxo-1H-pyridin-3-yl]-(4-fluorophenyl)methyl]-6-hydroxy-2-[4-(4-methoxyphenyl)piperazin-1-yl]-4-oxo-1H-pyridine-3-carboxylate CAS Name: 5-[[5-ethoxycarbonyl-2-hydroxy-6-[4-(4-methoxyphenyl)-1-piperazinyl]-4-oxo-1H-pyridin-3-yl]-(4-fluorophenyl)methyl]-6-hydroxy-2-[4-(4-methoxyphenyl)-1-piperazinyl]-4-oxo-1H-pyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[[5-ethoxycarbonyl-2-hydroxy-6-[4-(4-methoxyphenyl)piperazin-1-yl]-4-oxo-1H-pyridin-3-yl]-(4-fluorophenyl)methyl]-6-hydroxy-2-[4-(4-methoxyphenyl)piperazin-1-yl]-4-oxo-1H-pyridine-3-carboxylate Traditional Name: 5-[[5-carbethoxy-2-hydroxy-4-keto-6-[4-(4-methoxyphenyl)piperazino]-1H-pyridin-3-yl]-(4-fluorophenyl)methyl]-6-hydroxy-4-keto-2-[4-(4-methoxyphenyl)piperazino]-1H-pyridine-3-carboxylic acid ethyl ester Formula: C45H49FN6O10 MolecularWeight: 852.903163

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1=O)C(C2=CC=C(C=C2)F)C3=C(NC(=C(C3=O)C(=O)OCC)N4CCN(CC4)C5=CC=C(C=C5)OC)O)O)N6CCN(CC6)C7=CC=C(C=C7)OC

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1=O)C(C2=CC=C(C=C2)F)C3=C(NC(=C(C3=O)C(=O)OCC)N4CCN(CC4)C5=CC=C(C=C5)OC)O)O)N6CCN(CC6)C7=CC=C(C=C7)OC

InChI

InChI=1S/C45H49FN6O10/c1-5-61-44(57)36-38(53)34(42(55)47-40(36)51-23-19-49(20-24-51)29-11-15-31(59-3)16-12-29)33(27-7-9-28(46)10-8-27)35-39(54)37(45(58)62-6-2)41(48-43(35)56)52-25-21-50(22-26-52)30-13-17-32(60-4)18-14-30/h7-18,33H,5-6,19-26H2,1-4H3,(H2,47,53,55)(H2,48,54,56)