N-[5-(3-bromanyl-1-adamantyl)-2-methyl-phenyl]-3,5-dimethoxy-benzamide

Systemtic Name: N-[5-(3-bromanyl-1-adamantyl)-2-methyl-phenyl]-3,5-dimethoxy-benzamide Openeye Name: N-[5-(3-bromo-1-adamantyl)-2-methyl-phenyl]-3,5-dimethoxy-benzamide CAS Name: N-[5-(3-bromo-1-adamantyl)-2-methylphenyl]-3,5-dimethoxybenzamide IUPAC Name: N-[5-(3-bromo-1-adamantyl)-2-methylphenyl]-3,5-dimethoxybenzamide Traditional Name: N-[5-(3-bromo-1-adamantyl)-2-methyl-phenyl]-3,5-dimethoxy-benzamide Formula: C26H30BrNO3 MolecularWeight: 484.4253

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C23CC4CC(C2)CC(C4)(C3)Br)NC(=O)C5=CC(=CC(=C5)OC)OC

Isomeric SMILES

CC1=C(C=C(C=C1)C23CC4CC(C2)CC(C4)(C3)Br)NC(=O)C5=CC(=CC(=C5)OC)OC

InChI

InChI=1S/C26H30BrNO3/c1-16-4-5-20(25-11-17-6-18(12-25)14-26(27,13-17)15-25)9-23(16)28-24(29)19-7-21(30-2)10-22(8-19)31-3/h4-5,7-10,17-18H,6,11-15H2,1-3H3,(H,28,29)