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

Systemtic Name: [(2R)-1-(1-adamantylamino)-1-oxidanylidene-propan-2-yl]-methyl-(2-phenoxyethyl)azanium Openeye Name: [(1R)-2-(1-adamantylamino)-1-methyl-2-oxo-ethyl]-methyl-(2-phenoxyethyl)ammonium CAS Name: [(2R)-1-(1-adamantylamino)-1-oxopropan-2-yl]-methyl-(2-phenoxyethyl)ammonium IUPAC Name: [(2R)-1-(1-adamantylamino)-1-oxopropan-2-yl]-methyl-(2-phenoxyethyl)azanium Traditional Name: [(1R)-2-(1-adamantylamino)-2-keto-1-methyl-ethyl]-methyl-(2-phenoxyethyl)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)CCOC4=CC=CC=C4

Isomeric SMILES

C[C@H](C(=O)NC12CC3CC(C1)CC(C3)C2)[NH+](C)CCOC4=CC=CC=C4

InChI

InChI=1S/C22H32N2O2/c1-16(24(2)8-9-26-20-6-4-3-5-7-20)21(25)23-22-13-17-10-18(14-22)12-19(11-17)15-22/h3-7,16-19H,8-15H2,1-2H3,(H,23,25)/p+1/t16-,17?,18?,19?,22?/m1/s1