2-hydroxyethyl-[[(5S,7R)-3-(4-methylphenyl)-1-adamantyl]methyl]azanium

Systemtic Name: 2-hydroxyethyl-[[(5S,7R)-3-(4-methylphenyl)-1-adamantyl]methyl]azanium Openeye Name: 2-hydroxyethyl-[[(5S,7R)-3-(p-tolyl)-1-adamantyl]methyl]ammonium CAS Name: 2-hydroxyethyl-[[(5S,7R)-3-(4-methylphenyl)-1-adamantyl]methyl]ammonium IUPAC Name: 2-hydroxyethyl-[[(5S,7R)-3-(4-methylphenyl)-1-adamantyl]methyl]azanium Traditional Name: 2-hydroxyethyl-[[(5S,7R)-3-(p-tolyl)-1-adamantyl]methyl]ammonium Formula: C20H30NO+ MolecularWeight: 300.4583

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC=C(C=C1)C23C[C@@H]4C[C@H](C2)CC(C4)(C3)C[NH2+]CCO

InChI

InChI=1S/C20H29NO/c1-15-2-4-18(5-3-15)20-11-16-8-17(12-20)10-19(9-16,13-20)14-21-6-7-22/h2-5,16-17,21-22H,6-14H2,1H3/p+1/t16-,17+,19?,20?