2-[2-[(1-adamantylamino)methyl]-4-bromanyl-phenoxy]ethanamide

Systemtic Name: 2-[2-[(1-adamantylamino)methyl]-4-bromanyl-phenoxy]ethanamide Openeye Name: 2-[2-[(1-adamantylamino)methyl]-4-bromo-phenoxy]acetamide CAS Name: 2-[2-[(1-adamantylamino)methyl]-4-bromophenoxy]acetamide IUPAC Name: 2-[2-[(1-adamantylamino)methyl]-4-bromophenoxy]acetamide Traditional Name: 2-[2-[(1-adamantylamino)methyl]-4-bromo-phenoxy]acetamide Formula: C19H25BrN2O2 MolecularWeight: 393.318

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NCC4=C(C=CC(=C4)Br)OCC(=O)N

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NCC4=C(C=CC(=C4)Br)OCC(=O)N

InChI

InChI=1S/C19H25BrN2O2/c20-16-1-2-17(24-11-18(21)23)15(6-16)10-22-19-7-12-3-13(8-19)5-14(4-12)9-19/h1-2,6,12-14,22H,3-5,7-11H2,(H2,21,23)