3-bromanyl-N-methyl-N-[2-(4-methylphenoxy)ethyl]adamantane-1-carboxamide

Systemtic Name: 3-bromanyl-N-methyl-N-[2-(4-methylphenoxy)ethyl]adamantane-1-carboxamide Openeye Name: 3-bromo-N-methyl-N-[2-(4-methylphenoxy)ethyl]adamantane-1-carboxamide CAS Name: 3-bromo-N-methyl-N-[2-(4-methylphenoxy)ethyl]-1-adamantanecarboxamide IUPAC Name: 3-bromo-N-methyl-N-[2-(4-methylphenoxy)ethyl]adamantane-1-carboxamide Traditional Name: 3-bromo-N-methyl-N-[2-(4-methylphenoxy)ethyl]adamantane-1-carboxamide Formula: C21H28BrNO2 MolecularWeight: 406.35652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCCN(C)C(=O)C23CC4CC(C2)CC(C4)(C3)Br

Isomeric SMILES

CC1=CC=C(C=C1)OCCN(C)C(=O)C23CC4CC(C2)CC(C4)(C3)Br

InChI

InChI=1S/C21H28BrNO2/c1-15-3-5-18(6-4-15)25-8-7-23(2)19(24)20-10-16-9-17(11-20)13-21(22,12-16)14-20/h3-6,16-17H,7-14H2,1-2H3