N-[(4-nitrophenyl)-[2-[3-[2-[[(4-nitrophenyl)-[phenyl(phenylcarbonyl)amino]methyl]amino]ethyl]-1-adamantyl]ethylamino]methyl]-N-phenyl-benzamide

Systemtic Name: N-[(4-nitrophenyl)-[2-[3-[2-[[(4-nitrophenyl)-[phenyl(phenylcarbonyl)amino]methyl]amino]ethyl]-1-adamantyl]ethylamino]methyl]-N-phenyl-benzamide Openeye Name: N-[[2-[3-[2-[[(N-benzoylanilino)-(4-nitrophenyl)methyl]amino]ethyl]-1-adamantyl]ethylamino]-(4-nitrophenyl)methyl]-N-phenyl-benzamide CAS Name: N-[[2-[3-[2-[[(N-benzoylanilino)-(4-nitrophenyl)methyl]amino]ethyl]-1-adamantyl]ethylamino]-(4-nitrophenyl)methyl]-N-phenylbenzamide IUPAC Name: N-[[2-[3-[2-[[(N-benzoylanilino)-(4-nitrophenyl)methyl]amino]ethyl]-1-adamantyl]ethylamino]-(4-nitrophenyl)methyl]-N-phenylbenzamide Traditional Name: N-[[2-[3-[2-[[(N-benzoylanilino)-(4-nitrophenyl)methyl]amino]ethyl]-1-adamantyl]ethylamino]-(4-nitrophenyl)methyl]-N-phenyl-benzamide Formula: C54H54N6O6 MolecularWeight: 883.04316

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)CCNC(C4=CC=C(C=C4)[N+](=O)[O-])N(C5=CC=CC=C5)C(=O)C6=CC=CC=C6)CCNC(C7=CC=C(C=C7)[N+](=O)[O-])N(C8=CC=CC=C8)C(=O)C9=CC=CC=C9

Isomeric SMILES

C1C2CC3(CC1CC(C2)(C3)CCNC(C4=CC=C(C=C4)[N+](=O)[O-])N(C5=CC=CC=C5)C(=O)C6=CC=CC=C6)CCNC(C7=CC=C(C=C7)[N+](=O)[O-])N(C8=CC=CC=C8)C(=O)C9=CC=CC=C9

InChI

InChI=1S/C54H54N6O6/c61-51(43-13-5-1-6-14-43)57(45-17-9-3-10-18-45)49(41-21-25-47(26-22-41)59(63)64)55-31-29-53-34-39-33-40(35-53)37-54(36-39,38-53)30-32-56-50(42-23-27-48(28-24-42)60(65)66)58(46-19-11-4-12-20-46)52(62)44-15-7-2-8-16-44/h1-28,39-40,49-50,55-56H,29-38H2