3-bromanyl-N-[2-(propylcarbamoyl)phenyl]adamantane-1-carboxamide

Systemtic Name: 3-bromanyl-N-[2-(propylcarbamoyl)phenyl]adamantane-1-carboxamide Openeye Name: 3-bromo-N-[2-(propylcarbamoyl)phenyl]adamantane-1-carboxamide CAS Name: 3-bromo-N-[2-[oxo(propylamino)methyl]phenyl]-1-adamantanecarboxamide IUPAC Name: 3-bromo-N-[2-(propylcarbamoyl)phenyl]adamantane-1-carboxamide Traditional Name: 3-bromo-N-[2-(propylcarbamoyl)phenyl]adamantane-1-carboxamide Formula: C21H27BrN2O2 MolecularWeight: 419.35528

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CC=CC=C1NC(=O)C23CC4CC(C2)CC(C4)(C3)Br

Isomeric SMILES

CCCNC(=O)C1=CC=CC=C1NC(=O)C23CC4CC(C2)CC(C4)(C3)Br

InChI

InChI=1S/C21H27BrN2O2/c1-2-7-23-18(25)16-5-3-4-6-17(16)24-19(26)20-9-14-8-15(10-20)12-21(22,11-14)13-20/h3-6,14-15H,2,7-13H2,1H3,(H,23,25)(H,24,26)