[(1R)-1-(1-adamantyl)-2-(2-methylphenoxy)ethyl]azanium

Systemtic Name: [(1R)-1-(1-adamantyl)-2-(2-methylphenoxy)ethyl]azanium Openeye Name: [(1R)-1-(1-adamantyl)-2-(2-methylphenoxy)ethyl]ammonium CAS Name: [(1R)-1-(1-adamantyl)-2-(2-methylphenoxy)ethyl]ammonium IUPAC Name: [(1R)-1-(1-adamantyl)-2-(2-methylphenoxy)ethyl]azanium Traditional Name: [(1R)-1-(1-adamantyl)-2-(2-methylphenoxy)ethyl]ammonium Formula: C19H28NO+ MolecularWeight: 286.43172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCC(C23CC4CC(C2)CC(C4)C3)[NH3+]

Isomeric SMILES

CC1=CC=CC=C1OC[C@@H](C23CC4CC(C2)CC(C4)C3)[NH3+]

InChI

InChI=1S/C19H27NO/c1-13-4-2-3-5-17(13)21-12-18(20)19-9-14-6-15(10-19)8-16(7-14)11-19/h2-5,14-16,18H,6-12,20H2,1H3/p+1/t14?,15?,16?,18-,19?/m0/s1