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

Systemtic Name: [2-(1-adamantylamino)-2-oxidanylidene-ethyl]-methyl-(phenylmethyl)azanium Openeye Name: [2-(1-adamantylamino)-2-oxo-ethyl]-benzyl-methyl-ammonium CAS Name: [2-(1-adamantylamino)-2-oxoethyl]-methyl-(phenylmethyl)ammonium IUPAC Name: [2-(1-adamantylamino)-2-oxoethyl]-benzyl-methylazanium Traditional Name: [2-(1-adamantylamino)-2-keto-ethyl]-benzyl-methyl-ammonium Formula: C20H29N2O+ MolecularWeight: 313.45706

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1)CC(=O)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

C[NH+](CC1=CC=CC=C1)CC(=O)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C20H28N2O/c1-22(13-15-5-3-2-4-6-15)14-19(23)21-20-10-16-7-17(11-20)9-18(8-16)12-20/h2-6,16-18H,7-14H2,1H3,(H,21,23)/p+1