N-[4-[2-(1-adamantyl)ethanoylamino]-2-methyl-phenyl]-1-benzofuran-2-carboxamide

Systemtic Name: N-[4-[2-(1-adamantyl)ethanoylamino]-2-methyl-phenyl]-1-benzofuran-2-carboxamide Openeye Name: N-[4-[[2-(1-adamantyl)acetyl]amino]-2-methyl-phenyl]benzofuran-2-carboxamide CAS Name: N-[4-[[2-(1-adamantyl)-1-oxoethyl]amino]-2-methylphenyl]-2-benzofurancarboxamide IUPAC Name: N-[4-[[2-(1-adamantyl)acetyl]amino]-2-methylphenyl]-1-benzofuran-2-carboxamide Traditional Name: N-[4-[[2-(1-adamantyl)acetyl]amino]-2-methyl-phenyl]coumarilamide Formula: C28H30N2O3 MolecularWeight: 442.5494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)CC23CC4CC(C2)CC(C4)C3)NC(=O)C5=CC6=CC=CC=C6O5

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)CC23CC4CC(C2)CC(C4)C3)NC(=O)C5=CC6=CC=CC=C6O5

InChI

InChI=1S/C28H30N2O3/c1-17-8-22(29-26(31)16-28-13-18-9-19(14-28)11-20(10-18)15-28)6-7-23(17)30-27(32)25-12-21-4-2-3-5-24(21)33-25/h2-8,12,18-20H,9-11,13-16H2,1H3,(H,29,31)(H,30,32)