[5-(1-adamantyl)-2-(phenylmethyl)benzimidazol-1-yl]-phenyl-methanone

Systemtic Name: [5-(1-adamantyl)-2-(phenylmethyl)benzimidazol-1-yl]-phenyl-methanone Openeye Name: [5-(1-adamantyl)-2-benzyl-benzimidazol-1-yl]-phenyl-methanone CAS Name: [5-(1-adamantyl)-2-(phenylmethyl)-1-benzimidazolyl]-phenylmethanone IUPAC Name: [5-(1-adamantyl)-2-benzylbenzimidazol-1-yl]-phenylmethanone Traditional Name: [5-(1-adamantyl)-2-benzyl-benzimidazol-1-yl]-phenyl-methanone Formula: C31H30N2O MolecularWeight: 446.5827

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CC5=C(C=C4)N(C(=N5)CC6=CC=CC=C6)C(=O)C7=CC=CC=C7

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CC5=C(C=C4)N(C(=N5)CC6=CC=CC=C6)C(=O)C7=CC=CC=C7

InChI

InChI=1S/C31H30N2O/c34-30(25-9-5-2-6-10-25)33-28-12-11-26(31-18-22-13-23(19-31)15-24(14-22)20-31)17-27(28)32-29(33)16-21-7-3-1-4-8-21/h1-12,17,22-24H,13-16,18-20H2