cyclohexyl-[1-[7-(4-cyclohexylcarbonylpiperidin-1-yl)sulfonyl-9-nitroso-10-(oxidanylamino)anthracen-2-yl]sulfonylpiperidin-4-yl]methanone

Systemtic Name: cyclohexyl-[1-[7-(4-cyclohexylcarbonylpiperidin-1-yl)sulfonyl-9-nitroso-10-(oxidanylamino)anthracen-2-yl]sulfonylpiperidin-4-yl]methanone Openeye Name: [1-[[7-[[4-(cyclohexanecarbonyl)-1-piperidyl]sulfonyl]-10-(hydroxyamino)-9-nitroso-2-anthryl]sulfonyl]-4-piperidyl]-cyclohexyl-methanone CAS Name: cyclohexyl-[1-[[7-[[4-[cyclohexyl(oxo)methyl]-1-piperidinyl]sulfonyl]-10-(hydroxyamino)-9-nitroso-2-anthracenyl]sulfonyl]-4-piperidinyl]methanone IUPAC Name: [1-[7-[4-(cyclohexanecarbonyl)piperidin-1-yl]sulfonyl-10-(hydroxyamino)-9-nitrosoanthracen-2-yl]sulfonylpiperidin-4-yl]-cyclohexylmethanone Traditional Name: [1-[[7-[4-(cyclohexanecarbonyl)piperidino]sulfonyl-10-(hydroxyamino)-9-nitroso-2-anthryl]sulfonyl]-4-piperidyl]-cyclohexyl-methanone Formula: C38H48N4O8S2 MolecularWeight: 752.93972

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)C(=C5C=CC(=CC5=C4N=O)S(=O)(=O)N6CCC(CC6)C(=O)C7CCCCC7)NO

Isomeric SMILES

C1CCC(CC1)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)C(=C5C=CC(=CC5=C4N=O)S(=O)(=O)N6CCC(CC6)C(=O)C7CCCCC7)NO

InChI

InChI=1S/C38H48N4O8S2/c43-37(25-7-3-1-4-8-25)27-15-19-41(20-16-27)51(47,48)29-11-13-31-33(23-29)36(40-46)34-24-30(12-14-32(34)35(31)39-45)52(49,50)42-21-17-28(18-22-42)38(44)26-9-5-2-6-10-26/h11-14,23-28,39,45H,1-10,15-22H2