[2-(1-adamantylmethylamino)-2-oxidanylidene-ethyl]-[(4-methoxyphenyl)methyl]-methyl-azanium

Systemtic Name: [2-(1-adamantylmethylamino)-2-oxidanylidene-ethyl]-[(4-methoxyphenyl)methyl]-methyl-azanium Openeye Name: [2-(1-adamantylmethylamino)-2-oxo-ethyl]-[(4-methoxyphenyl)methyl]-methyl-ammonium CAS Name: [2-(1-adamantylmethylamino)-2-oxoethyl]-[(4-methoxyphenyl)methyl]-methylammonium IUPAC Name: [2-(1-adamantylmethylamino)-2-oxoethyl]-[(4-methoxyphenyl)methyl]-methylazanium Traditional Name: [2-(1-adamantylmethylamino)-2-keto-ethyl]-methyl-p-anisyl-ammonium Formula: C22H33N2O2+ MolecularWeight: 357.50962

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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