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

Systemtic Name: [(2R)-1-(1-adamantylamino)-1-oxidanylidene-propan-2-yl]-methyl-[(4-prop-2-enoxyphenyl)methyl]azanium Openeye Name: [(1R)-2-(1-adamantylamino)-1-methyl-2-oxo-ethyl]-[(4-allyloxyphenyl)methyl]-methyl-ammonium CAS Name: [(2R)-1-(1-adamantylamino)-1-oxopropan-2-yl]-methyl-[(4-prop-2-enoxyphenyl)methyl]ammonium IUPAC Name: [(2R)-1-(1-adamantylamino)-1-oxopropan-2-yl]-methyl-[(4-prop-2-enoxyphenyl)methyl]azanium Traditional Name: [(1R)-2-(1-adamantylamino)-2-keto-1-methyl-ethyl]-(4-allyloxybenzyl)-methyl-ammonium Formula: C24H35N2O2+ MolecularWeight: 383.5469

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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)OCC=C

Isomeric SMILES

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

InChI

InChI=1S/C24H34N2O2/c1-4-9-28-22-7-5-18(6-8-22)16-26(3)17(2)23(27)25-24-13-19-10-20(14-24)12-21(11-19)15-24/h4-8,17,19-21H,1,9-16H2,2-3H3,(H,25,27)/p+1/t17-,19?,20?,21?,24?/m1/s1