2,7-bis[[4-(furan-2-ylcarbonyl)piperazin-1-yl]sulfonyl]-4,5-dinitro-fluoren-9-one

Systemtic Name: 2,7-bis[[4-(furan-2-ylcarbonyl)piperazin-1-yl]sulfonyl]-4,5-dinitro-fluoren-9-one Openeye Name: 2,7-bis[[4-(furan-2-carbonyl)piperazin-1-yl]sulfonyl]-4,5-dinitro-fluoren-9-one CAS Name: 2,7-bis[[4-[2-furanyl(oxo)methyl]-1-piperazinyl]sulfonyl]-4,5-dinitro-9-fluorenone IUPAC Name: 2,7-bis[[4-(furan-2-carbonyl)piperazin-1-yl]sulfonyl]-4,5-dinitrofluoren-9-one Traditional Name: 2,7-bis[[4-(2-furoyl)piperazino]sulfonyl]-4,5-dinitro-fluoren-9-one Formula: C31H26N6O13S2 MolecularWeight: 754.70054

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=CO2)S(=O)(=O)C3=CC(=C4C(=C3)C(=O)C5=CC(=CC(=C54)[N+](=O)[O-])S(=O)(=O)N6CCN(CC6)C(=O)C7=CC=CO7)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=CO2)S(=O)(=O)C3=CC(=C4C(=C3)C(=O)C5=CC(=CC(=C54)[N+](=O)[O-])S(=O)(=O)N6CCN(CC6)C(=O)C7=CC=CO7)[N+](=O)[O-]

InChI

InChI=1S/C31H26N6O13S2/c38-29-21-15-19(51(45,46)34-9-5-32(6-10-34)30(39)25-3-1-13-49-25)17-23(36(41)42)27(21)28-22(29)16-20(18-24(28)37(43)44)52(47,48)35-11-7-33(8-12-35)31(40)26-4-2-14-50-26/h1-4,13-18H,5-12H2