1-cyclohexyl-2-[2-[diethyl(methyl)azaniumyl]ethoxy]-2-oxidanylidene-1-phenyl-ethanolate

Systemtic Name: 1-cyclohexyl-2-[2-[diethyl(methyl)azaniumyl]ethoxy]-2-oxidanylidene-1-phenyl-ethanolate Openeye Name: 1-cyclohexyl-2-[2-[diethyl(methyl)ammonio]ethoxy]-2-oxo-1-phenyl-ethanolate CAS Name: 1-cyclohexyl-2-[2-[diethyl(methyl)ammonio]ethoxy]-2-oxo-1-phenylethanolate IUPAC Name: 1-cyclohexyl-2-[2-[diethyl(methyl)azaniumyl]ethoxy]-2-oxo-1-phenylethanolate Traditional Name: 1-cyclohexyl-2-[2-[diethyl(methyl)ammonio]ethoxy]-2-keto-1-phenyl-ethanolate Formula: C21H33NO3 MolecularWeight: 347.49162

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](C)(CC)CCOC(=O)C(C1CCCCC1)(C2=CC=CC=C2)[O-]

Isomeric SMILES

CC[N+](C)(CC)CCOC(=O)C(C1CCCCC1)(C2=CC=CC=C2)[O-]

InChI

InChI=1S/C21H33NO3/c1-4-22(3,5-2)16-17-25-20(23)21(24,18-12-8-6-9-13-18)19-14-10-7-11-15-19/h6,8-9,12-13,19H,4-5,7,10-11,14-17H2,1-3H3