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

Systemtic Name: [2-(1-adamantylmethylamino)-2-oxidanylidene-ethyl]-methyl-(phenylmethyl)azanium Openeye Name: [2-(1-adamantylmethylamino)-2-oxo-ethyl]-benzyl-methyl-ammonium CAS Name: [2-(1-adamantylmethylamino)-2-oxoethyl]-methyl-(phenylmethyl)ammonium IUPAC Name: [2-(1-adamantylmethylamino)-2-oxoethyl]-benzyl-methylazanium Traditional Name: [2-(1-adamantylmethylamino)-2-keto-ethyl]-benzyl-methyl-ammonium Formula: C21H31N2O+ MolecularWeight: 327.48364

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1)CC(=O)NCC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

C[NH+](CC1=CC=CC=C1)CC(=O)NCC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C21H30N2O/c1-23(13-16-5-3-2-4-6-16)14-20(24)22-15-21-10-17-7-18(11-21)9-19(8-17)12-21/h2-6,17-19H,7-15H2,1H3,(H,22,24)/p+1