2-adamantyl-[(2R)-1-(1-adamantylcarbamoylamino)-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: 2-adamantyl-[(2R)-1-(1-adamantylcarbamoylamino)-1-oxidanylidene-propan-2-yl]azanium Openeye Name: 2-adamantyl-[(1R)-2-(1-adamantylcarbamoylamino)-1-methyl-2-oxo-ethyl]ammonium CAS Name: 2-adamantyl-[(2R)-1-[[(1-adamantylamino)-oxomethyl]amino]-1-oxopropan-2-yl]ammonium IUPAC Name: 2-adamantyl-[(2R)-1-(1-adamantylcarbamoylamino)-1-oxopropan-2-yl]azanium Traditional Name: 2-adamantyl-[(1R)-2-(1-adamantylcarbamoylamino)-2-keto-1-methyl-ethyl]ammonium Formula: C24H38N3O2+ MolecularWeight: 400.57742

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC12CC3CC(C1)CC(C3)C2)[NH2+]C4C5CC6CC(C5)CC4C6

Isomeric SMILES

C[C@H](C(=O)NC(=O)NC12CC3CC(C1)CC(C3)C2)[NH2+]C4C5CC6CC(C5)CC4C6

InChI

InChI=1S/C24H37N3O2/c1-13(25-21-19-6-14-2-15(8-19)9-20(21)7-14)22(28)26-23(29)27-24-10-16-3-17(11-24)5-18(4-16)12-24/h13-21,25H,2-12H2,1H3,(H2,26,27,28,29)/p+1/t13-,14?,15?,16?,17?,18?,19?,20?,21?,24?/m1/s1