[2-(1-adamantylamino)-2-oxidanylidene-ethyl]-bis(phenylmethyl)azanium

Systemtic Name: [2-(1-adamantylamino)-2-oxidanylidene-ethyl]-bis(phenylmethyl)azanium Openeye Name: [2-(1-adamantylamino)-2-oxo-ethyl]-dibenzyl-ammonium CAS Name: [2-(1-adamantylamino)-2-oxoethyl]-bis(phenylmethyl)ammonium IUPAC Name: [2-(1-adamantylamino)-2-oxoethyl]-dibenzylazanium Traditional Name: [2-(1-adamantylamino)-2-keto-ethyl]-dibenzyl-ammonium Formula: C26H33N2O+ MolecularWeight: 389.55302

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)C[NH+](CC4=CC=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)C[NH+](CC4=CC=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C26H32N2O/c29-25(27-26-14-22-11-23(15-26)13-24(12-22)16-26)19-28(17-20-7-3-1-4-8-20)18-21-9-5-2-6-10-21/h1-10,22-24H,11-19H2,(H,27,29)/p+1