2-[2-[[[(1R)-1-(1-adamantyl)ethyl]amino]methyl]-4-bromanyl-phenoxy]ethanamide

Systemtic Name: 2-[2-[[[(1R)-1-(1-adamantyl)ethyl]amino]methyl]-4-bromanyl-phenoxy]ethanamide Openeye Name: 2-[2-[[[(1R)-1-(1-adamantyl)ethyl]amino]methyl]-4-bromo-phenoxy]acetamide CAS Name: 2-[2-[[[(1R)-1-(1-adamantyl)ethyl]amino]methyl]-4-bromophenoxy]acetamide IUPAC Name: 2-[2-[[[(1R)-1-(1-adamantyl)ethyl]amino]methyl]-4-bromophenoxy]acetamide Traditional Name: 2-[2-[[[(1R)-1-(1-adamantyl)ethyl]amino]methyl]-4-bromo-phenoxy]acetamide Formula: C21H29BrN2O2 MolecularWeight: 421.37116

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Descriptors Computed from Structure

Canonical SMILES:

CC(C12CC3CC(C1)CC(C3)C2)NCC4=C(C=CC(=C4)Br)OCC(=O)N

Isomeric SMILES

C[C@H](C12CC3CC(C1)CC(C3)C2)NCC4=C(C=CC(=C4)Br)OCC(=O)N

InChI

InChI=1S/C21H29BrN2O2/c1-13(21-8-14-4-15(9-21)6-16(5-14)10-21)24-11-17-7-18(22)2-3-19(17)26-12-20(23)25/h2-3,7,13-16,24H,4-6,8-12H2,1H3,(H2,23,25)/t13-,14?,15?,16?,21?/m1/s1