2-[[3-(1-adamantyl)-2,4,5-tris(oxidanylidene)imidazolidin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 2-[[3-(1-adamantyl)-2,4,5-tris(oxidanylidene)imidazolidin-1-yl]methyl]benzenecarbonitrile Openeye Name: 2-[[3-(1-adamantyl)-2,4,5-trioxo-imidazolidin-1-yl]methyl]benzonitrile CAS Name: 2-[[3-(1-adamantyl)-2,4,5-trioxo-1-imidazolidinyl]methyl]benzonitrile IUPAC Name: 2-[[3-(1-adamantyl)-2,4,5-trioxoimidazolidin-1-yl]methyl]benzonitrile Traditional Name: 2-[[3-(1-adamantyl)-2,4,5-triketo-imidazolidin-1-yl]methyl]benzonitrile Formula: C21H21N3O3 MolecularWeight: 363.40974

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)N4C(=O)C(=O)N(C4=O)CC5=CC=CC=C5C#N

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)N4C(=O)C(=O)N(C4=O)CC5=CC=CC=C5C#N

InChI

InChI=1S/C21H21N3O3/c22-11-16-3-1-2-4-17(16)12-23-18(25)19(26)24(20(23)27)21-8-13-5-14(9-21)7-15(6-13)10-21/h1-4,13-15H,5-10,12H2