[(3R,5S)-3,5-dimethyl-1-adamantyl]-[(4-methylphenyl)methyl]azanium

Systemtic Name: [(3R,5S)-3,5-dimethyl-1-adamantyl]-[(4-methylphenyl)methyl]azanium Openeye Name: [(3R,5S)-3,5-dimethyl-1-adamantyl]-(p-tolylmethyl)ammonium CAS Name: [(3R,5S)-3,5-dimethyl-1-adamantyl]-[(4-methylphenyl)methyl]ammonium IUPAC Name: [(3R,5S)-3,5-dimethyl-1-adamantyl]-[(4-methylphenyl)methyl]azanium Traditional Name: [(3R,5S)-3,5-dimethyl-1-adamantyl]-(4-methylbenzyl)ammonium Formula: C20H30N+ MolecularWeight: 284.4589

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[NH2+]C23CC4CC(C2)(CC(C4)(C3)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C[NH2+]C23CC4C[C@@](C2)(C[C@](C4)(C3)C)C

InChI

InChI=1S/C20H29N/c1-15-4-6-16(7-5-15)11-21-20-10-17-8-18(2,13-20)12-19(3,9-17)14-20/h4-7,17,21H,8-14H2,1-3H3/p+1/t17?,18-,19+,20?