N-[3-[2-(3-bromanyl-1-adamantyl)ethanoylamino]phenyl]cyclopropanecarboxamide

Systemtic Name: N-[3-[2-(3-bromanyl-1-adamantyl)ethanoylamino]phenyl]cyclopropanecarboxamide Openeye Name: N-[3-[[2-(3-bromo-1-adamantyl)acetyl]amino]phenyl]cyclopropanecarboxamide CAS Name: N-[3-[[2-(3-bromo-1-adamantyl)-1-oxoethyl]amino]phenyl]cyclopropanecarboxamide IUPAC Name: N-[3-[[2-(3-bromo-1-adamantyl)acetyl]amino]phenyl]cyclopropanecarboxamide Traditional Name: N-[3-[[2-(3-bromo-1-adamantyl)acetyl]amino]phenyl]cyclopropanecarboxamide Formula: C22H27BrN2O2 MolecularWeight: 431.36598

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)NC2=CC(=CC=C2)NC(=O)CC34CC5CC(C3)CC(C5)(C4)Br

Isomeric SMILES

C1CC1C(=O)NC2=CC(=CC=C2)NC(=O)CC34CC5CC(C3)CC(C5)(C4)Br

InChI

InChI=1S/C22H27BrN2O2/c23-22-10-14-6-15(11-22)9-21(8-14,13-22)12-19(26)24-17-2-1-3-18(7-17)25-20(27)16-4-5-16/h1-3,7,14-16H,4-6,8-13H2,(H,24,26)(H,25,27)