2-adamantyl N-[3-[2-(dimethylcarbamoyl)-1-benzofuran-3-yl]-2-methyl-1-oxidanylidene-1-(phenethylamino)propan-2-yl]carbamate

Systemtic Name: 2-adamantyl N-[3-[2-(dimethylcarbamoyl)-1-benzofuran-3-yl]-2-methyl-1-oxidanylidene-1-(phenethylamino)propan-2-yl]carbamate Openeye Name: 2-adamantyl N-[1-[[2-(dimethylcarbamoyl)benzofuran-3-yl]methyl]-1-methyl-2-oxo-2-(phenethylamino)ethyl]carbamate CAS Name: N-[3-[2-[dimethylamino(oxo)methyl]-3-benzofuranyl]-2-methyl-1-oxo-1-(phenethylamino)propan-2-yl]carbamic acid 2-adamantyl ester IUPAC Name: 2-adamantyl N-[3-[2-(dimethylcarbamoyl)-1-benzofuran-3-yl]-2-methyl-1-oxo-1-(phenethylamino)propan-2-yl]carbamate Traditional Name: N-[1-[[2-(dimethylcarbamoyl)benzofuran-3-yl]methyl]-2-keto-1-methyl-2-(phenethylamino)ethyl]carbamic acid 2-adamantyl ester Formula: C34H41N3O5 MolecularWeight: 571.70644

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=C(OC2=CC=CC=C21)C(=O)N(C)C)(C(=O)NCCC3=CC=CC=C3)NC(=O)OC4C5CC6CC(C5)CC4C6

Isomeric SMILES

CC(CC1=C(OC2=CC=CC=C21)C(=O)N(C)C)(C(=O)NCCC3=CC=CC=C3)NC(=O)OC4C5CC6CC(C5)CC4C6

InChI

InChI=1S/C34H41N3O5/c1-34(32(39)35-14-13-21-9-5-4-6-10-21,20-27-26-11-7-8-12-28(26)41-30(27)31(38)37(2)3)36-33(40)42-29-24-16-22-15-23(18-24)19-25(29)17-22/h4-12,22-25,29H,13-20H2,1-3H3,(H,35,39)(H,36,40)