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1-adamantyl-[2-oxidanylidene-2-[(2,4,6-trimethylphenyl)amino]ethyl]azanium

1-adamantyl-[2-oxidanylidene-2-[(2,4,6-trimethylphenyl)amino]ethyl]azanium

Systemtic Name:1-adamantyl-[2-oxidanylidene-2-[(2,4,6-trimethylphenyl)amino]ethyl]azanium
Openeye Name:1-adamantyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]ammonium
CAS Name:1-adamantyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]ammonium
IUPAC Name:1-adamantyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]azanium
Traditional Name:1-adamantyl-(2-keto-2-mesidino-ethyl)ammonium
Formula: C21H31N2O+
MolecularWeight: 327.48364
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)C[NH2+]C23CC4CC(C2)CC(C4)C3)C


Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)C[NH2+]C23CC4CC(C2)CC(C4)C3)C


InChI

InChI=1S/C21H30N2O/c1-13-4-14(2)20(15(3)5-13)23-19(24)12-22-21-9-16-6-17(10-21)8-18(7-16)11-21/h4-5,16-18,22H,6-12H2,1-3H3,(H,23,24)/p+1


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