2-[3-(1-adamantyl)-4-methoxy-phenyl]-6-phenylmethoxy-1H-benzimidazole

Systemtic Name: 2-[3-(1-adamantyl)-4-methoxy-phenyl]-6-phenylmethoxy-1H-benzimidazole Openeye Name: 2-[3-(1-adamantyl)-4-methoxy-phenyl]-6-benzyloxy-1H-benzimidazole CAS Name: 2-[3-(1-adamantyl)-4-methoxyphenyl]-6-phenylmethoxy-1H-benzimidazole IUPAC Name: 2-[3-(1-adamantyl)-4-methoxyphenyl]-6-phenylmethoxy-1H-benzimidazole Traditional Name: 2-[3-(1-adamantyl)-4-methoxy-phenyl]-6-benzoxy-1H-benzimidazole Formula: C31H32N2O2 MolecularWeight: 464.59798

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC3=C(N2)C=C(C=C3)OCC4=CC=CC=C4)C56CC7CC(C5)CC(C7)C6

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC3=C(N2)C=C(C=C3)OCC4=CC=CC=C4)C56CC7CC(C5)CC(C7)C6

InChI

InChI=1S/C31H32N2O2/c1-34-29-10-7-24(14-26(29)31-16-21-11-22(17-31)13-23(12-21)18-31)30-32-27-9-8-25(15-28(27)33-30)35-19-20-5-3-2-4-6-20/h2-10,14-15,21-23H,11-13,16-19H2,1H3,(H,32,33)