[(2R)-1-(1-adamantylcarbamoylamino)-1-oxidanylidene-propan-2-yl]-[(4-dimethylaminophenyl)methyl]-methyl-azanium

Systemtic Name: [(2R)-1-(1-adamantylcarbamoylamino)-1-oxidanylidene-propan-2-yl]-[(4-dimethylaminophenyl)methyl]-methyl-azanium Openeye Name: [(1R)-2-(1-adamantylcarbamoylamino)-1-methyl-2-oxo-ethyl]-[(4-dimethylaminophenyl)methyl]-methyl-ammonium CAS Name: [(2R)-1-[[(1-adamantylamino)-oxomethyl]amino]-1-oxopropan-2-yl]-[(4-dimethylaminophenyl)methyl]-methylammonium IUPAC Name: [(2R)-1-(1-adamantylcarbamoylamino)-1-oxopropan-2-yl]-[(4-dimethylaminophenyl)methyl]-methylazanium Traditional Name: [(1R)-2-(1-adamantylcarbamoylamino)-2-keto-1-methyl-ethyl]-[4-(dimethylamino)benzyl]-methyl-ammonium Formula: C24H37N4O2+ MolecularWeight: 413.57618

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H36N4O2/c1-16(28(4)15-17-5-7-21(8-6-17)27(2)3)22(29)25-23(30)26-24-12-18-9-19(13-24)11-20(10-18)14-24/h5-8,16,18-20H,9-15H2,1-4H3,(H2,25,26,29,30)/p+1/t16-,18?,19?,20?,24?/m1/s1