2-adamantyl-[[3-methoxy-2-[(4-methylphenyl)methoxy]phenyl]methyl]azanium

Systemtic Name: 2-adamantyl-[[3-methoxy-2-[(4-methylphenyl)methoxy]phenyl]methyl]azanium Openeye Name: 2-adamantyl-[[3-methoxy-2-(p-tolylmethoxy)phenyl]methyl]ammonium CAS Name: 2-adamantyl-[[3-methoxy-2-[(4-methylphenyl)methoxy]phenyl]methyl]ammonium IUPAC Name: 2-adamantyl-[[3-methoxy-2-[(4-methylphenyl)methoxy]phenyl]methyl]azanium Traditional Name: 2-adamantyl-[3-methoxy-2-(4-methylbenzyl)oxy-benzyl]ammonium Formula: C26H34NO2+ MolecularWeight: 392.55366

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC2=C(C=CC=C2OC)C[NH2+]C3C4CC5CC(C4)CC3C5

Isomeric SMILES

CC1=CC=C(C=C1)COC2=C(C=CC=C2OC)C[NH2+]C3C4CC5CC(C4)CC3C5

InChI

InChI=1S/C26H33NO2/c1-17-6-8-18(9-7-17)16-29-26-21(4-3-5-24(26)28-2)15-27-25-22-11-19-10-20(13-22)14-23(25)12-19/h3-9,19-20,22-23,25,27H,10-16H2,1-2H3/p+1