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

Systemtic Name: 1-adamantyl-[[2-[(4-methylphenyl)methoxy]phenyl]methyl]azanium Openeye Name: 1-adamantyl-[[2-(p-tolylmethoxy)phenyl]methyl]ammonium CAS Name: 1-adamantyl-[[2-[(4-methylphenyl)methoxy]phenyl]methyl]ammonium IUPAC Name: 1-adamantyl-[[2-[(4-methylphenyl)methoxy]phenyl]methyl]azanium Traditional Name: 1-adamantyl-[2-(4-methylbenzyl)oxybenzyl]ammonium Formula: C25H32NO+ MolecularWeight: 362.52768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC2=CC=CC=C2C[NH2+]C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=CC=C(C=C1)COC2=CC=CC=C2C[NH2+]C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C25H31NO/c1-18-6-8-19(9-7-18)17-27-24-5-3-2-4-23(24)16-26-25-13-20-10-21(14-25)12-22(11-20)15-25/h2-9,20-22,26H,10-17H2,1H3/p+1