N2,N7-bis(4-tert-butylcyclohexyl)-9-nitroso-10-(oxidanylamino)anthracene-2,7-disulfonamide

Systemtic Name: N2,N7-bis(4-tert-butylcyclohexyl)-9-nitroso-10-(oxidanylamino)anthracene-2,7-disulfonamide Openeye Name: N2,N7-bis(4-tert-butylcyclohexyl)-10-(hydroxyamino)-9-nitroso-anthracene-2,7-disulfonamide CAS Name: N2,N7-bis(4-tert-butylcyclohexyl)-10-(hydroxyamino)-9-nitrosoanthracene-2,7-disulfonamide IUPAC Name: 2-N,7-N-bis(4-tert-butylcyclohexyl)-10-(hydroxyamino)-9-nitrosoanthracene-2,7-disulfonamide Traditional Name: N,N'-bis(4-tert-butylcyclohexyl)-10-(hydroxyamino)-9-nitroso-anthracene-2,7-disulfonamide Formula: C34H48N4O6S2 MolecularWeight: 672.89812

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(CC1)NS(=O)(=O)C2=CC3=C(C=C2)C(=C4C=CC(=CC4=C3N=O)S(=O)(=O)NC5CCC(CC5)C(C)(C)C)NO

Isomeric SMILES

CC(C)(C)C1CCC(CC1)NS(=O)(=O)C2=CC3=C(C=C2)C(=C4C=CC(=CC4=C3N=O)S(=O)(=O)NC5CCC(CC5)C(C)(C)C)NO

InChI

InChI=1S/C34H48N4O6S2/c1-33(2,3)21-7-11-23(12-8-21)37-45(41,42)25-15-17-27-29(19-25)32(36-40)30-20-26(16-18-28(30)31(27)35-39)46(43,44)38-24-13-9-22(10-14-24)34(4,5)6/h15-24,35,37-39H,7-14H2,1-6H3