[1-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-1-oxidanylidene-propan-2-yl] 2-(4-chloranyl-3-nitro-phenyl)carbonylbenzoate

Systemtic Name: [1-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-1-oxidanylidene-propan-2-yl] 2-(4-chloranyl-3-nitro-phenyl)carbonylbenzoate Openeye Name: [2-[4-(furan-2-carbonyl)piperazin-1-yl]-1-methyl-2-oxo-ethyl] 2-(4-chloro-3-nitro-benzoyl)benzoate CAS Name: 2-[(4-chloro-3-nitrophenyl)-oxomethyl]benzoic acid [1-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-1-oxopropan-2-yl] ester IUPAC Name: [1-[4-(furan-2-carbonyl)piperazin-1-yl]-1-oxopropan-2-yl] 2-(4-chloro-3-nitrobenzoyl)benzoate Traditional Name: 2-(4-chloro-3-nitro-benzoyl)benzoic acid [2-[4-(2-furoyl)piperazino]-2-keto-1-methyl-ethyl] ester Formula: C26H22ClN3O8 MolecularWeight: 539.92118

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C(=O)C2=CC=CO2)OC(=O)C3=CC=CC=C3C(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)N1CCN(CC1)C(=O)C2=CC=CO2)OC(=O)C3=CC=CC=C3C(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C26H22ClN3O8/c1-16(24(32)28-10-12-29(13-11-28)25(33)22-7-4-14-37-22)38-26(34)19-6-3-2-5-18(19)23(31)17-8-9-20(27)21(15-17)30(35)36/h2-9,14-16H,10-13H2,1H3