N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]-3-(4-methoxyphenyl)adamantane-1-carboxamide

Systemtic Name: N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]-3-(4-methoxyphenyl)adamantane-1-carboxamide Openeye Name: N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]-3-(4-methoxyphenyl)adamantane-1-carboxamide CAS Name: N-[[2-(1-imidazolylmethyl)phenyl]methyl]-3-(4-methoxyphenyl)-1-adamantanecarboxamide IUPAC Name: N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]-3-(4-methoxyphenyl)adamantane-1-carboxamide Traditional Name: N-[2-(imidazol-1-ylmethyl)benzyl]-3-(4-methoxyphenyl)adamantane-1-carboxamide Formula: C29H33N3O2 MolecularWeight: 455.59122

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C23CC4CC(C2)CC(C4)(C3)C(=O)NCC5=CC=CC=C5CN6C=CN=C6

Isomeric SMILES

COC1=CC=C(C=C1)C23CC4CC(C2)CC(C4)(C3)C(=O)NCC5=CC=CC=C5CN6C=CN=C6

InChI

InChI=1S/C29H33N3O2/c1-34-26-8-6-25(7-9-26)28-13-21-12-22(14-28)16-29(15-21,19-28)27(33)31-17-23-4-2-3-5-24(23)18-32-11-10-30-20-32/h2-11,20-22H,12-19H2,1H3,(H,31,33)