[(1R)-2-(1-adamantylcarbonylamino)-1-(4-ethylphenyl)ethyl]-dimethyl-azanium

Systemtic Name: [(1R)-2-(1-adamantylcarbonylamino)-1-(4-ethylphenyl)ethyl]-dimethyl-azanium Openeye Name: [(1R)-2-(adamantane-1-carbonylamino)-1-(4-ethylphenyl)ethyl]-dimethyl-ammonium CAS Name: [(1R)-2-[[1-adamantyl(oxo)methyl]amino]-1-(4-ethylphenyl)ethyl]-dimethylammonium IUPAC Name: [(1R)-2-(adamantane-1-carbonylamino)-1-(4-ethylphenyl)ethyl]-dimethylazanium Traditional Name: [(1R)-2-(adamantane-1-carbonylamino)-1-(4-ethylphenyl)ethyl]-dimethyl-ammonium Formula: C23H35N2O+ MolecularWeight: 355.5368

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(CNC(=O)C23CC4CC(C2)CC(C4)C3)[NH+](C)C

Isomeric SMILES

CCC1=CC=C(C=C1)[C@H](CNC(=O)C23CC4CC(C2)CC(C4)C3)[NH+](C)C

InChI

InChI=1S/C23H34N2O/c1-4-16-5-7-20(8-6-16)21(25(2)3)15-24-22(26)23-12-17-9-18(13-23)11-19(10-17)14-23/h5-8,17-19,21H,4,9-15H2,1-3H3,(H,24,26)/p+1/t17?,18?,19?,21-,23?/m0/s1