N-(1-adamantyl)-3,5-bis(bromanyl)-2-methoxy-benzamide

Systemtic Name: N-(1-adamantyl)-3,5-bis(bromanyl)-2-methoxy-benzamide Openeye Name: N-(1-adamantyl)-3,5-dibromo-2-methoxy-benzamide CAS Name: N-(1-adamantyl)-3,5-dibromo-2-methoxybenzamide IUPAC Name: N-(1-adamantyl)-3,5-dibromo-2-methoxybenzamide Traditional Name: N-(1-adamantyl)-3,5-dibromo-2-methoxy-benzamide Formula: C18H21Br2NO2 MolecularWeight: 443.17284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1C(=O)NC23CC4CC(C2)CC(C4)C3)Br)Br

Isomeric SMILES

COC1=C(C=C(C=C1C(=O)NC23CC4CC(C2)CC(C4)C3)Br)Br

InChI

InChI=1S/C18H21Br2NO2/c1-23-16-14(5-13(19)6-15(16)20)17(22)21-18-7-10-2-11(8-18)4-12(3-10)9-18/h5-6,10-12H,2-4,7-9H2,1H3,(H,21,22)