[2-(1-adamantylmethylamino)-2-oxidanylidene-ethyl]-[(3-methoxyphenyl)methyl]-methyl-azanium

Systemtic Name: [2-(1-adamantylmethylamino)-2-oxidanylidene-ethyl]-[(3-methoxyphenyl)methyl]-methyl-azanium Openeye Name: [2-(1-adamantylmethylamino)-2-oxo-ethyl]-[(3-methoxyphenyl)methyl]-methyl-ammonium CAS Name: [2-(1-adamantylmethylamino)-2-oxoethyl]-[(3-methoxyphenyl)methyl]-methylammonium IUPAC Name: [2-(1-adamantylmethylamino)-2-oxoethyl]-[(3-methoxyphenyl)methyl]-methylazanium Traditional Name: [2-(1-adamantylmethylamino)-2-keto-ethyl]-m-anisyl-methyl-ammonium Formula: C22H33N2O2+ MolecularWeight: 357.50962

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC(=CC=C1)OC)CC(=O)NCC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

C[NH+](CC1=CC(=CC=C1)OC)CC(=O)NCC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C22H32N2O2/c1-24(13-16-4-3-5-20(9-16)26-2)14-21(25)23-15-22-10-17-6-18(11-22)8-19(7-17)12-22/h3-5,9,17-19H,6-8,10-15H2,1-2H3,(H,23,25)/p+1