[(2R)-1-(1-adamantylamino)-1-oxidanylidene-propan-2-yl]-[(4-methoxyphenyl)methyl]-methyl-azanium

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC12CC3CC(C1)CC(C3)C2)[NH+](C)CC4=CC=C(C=C4)OC

Isomeric SMILES

C[C@H](C(=O)NC12CC3CC(C1)CC(C3)C2)[NH+](C)CC4=CC=C(C=C4)OC

InChI

InChI=1S/C22H32N2O2/c1-15(24(2)14-16-4-6-20(26-3)7-5-16)21(25)23-22-11-17-8-18(12-22)10-19(9-17)13-22/h4-7,15,17-19H,8-14H2,1-3H3,(H,23,25)/p+1/t15-,17?,18?,19?,22?/m1/s1