[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-diethyl-(phenylmethyl)azanium; hexadecanoate

Systemtic Name: [2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-diethyl-(phenylmethyl)azanium; hexadecanoate Openeye Name: benzyl-[2-(2,6-dimethylanilino)-2-oxo-ethyl]-diethyl-ammonium; hexadecanoate CAS Name: [2-(2,6-dimethylanilino)-2-oxoethyl]-diethyl-(phenylmethyl)ammonium; hexadecanoate IUPAC Name: benzyl-[2-(2,6-dimethylanilino)-2-oxoethyl]-diethylazanium; hexadecanoate Traditional Name: benzyl-[2-(2,6-dimethylanilino)-2-keto-ethyl]-diethyl-ammonium; palmitate Formula: C37H60N2O3 MolecularWeight: 580.8839

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)[O-].CC[N+](CC)(CC1=CC=CC=C1)CC(=O)NC2=C(C=CC=C2C)C

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)[O-].CC[N+](CC)(CC1=CC=CC=C1)CC(=O)NC2=C(C=CC=C2C)C

InChI

InChI=1S/C21H28N2O.C16H32O2/c1-5-23(6-2,15-19-13-8-7-9-14-19)16-20(24)22-21-17(3)11-10-12-18(21)4;1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h7-14H,5-6,15-16H2,1-4H3;2-15H2,1H3,(H,17,18)