1-cyclohexyl-1-phenyl-3-(triethylazaniumyl)propan-1-olate

Systemtic Name: 1-cyclohexyl-1-phenyl-3-(triethylazaniumyl)propan-1-olate Openeye Name: 1-cyclohexyl-1-phenyl-3-(triethylammonio)propan-1-olate CAS Name: 1-cyclohexyl-1-phenyl-3-(triethylammonio)-1-propanolate IUPAC Name: 1-cyclohexyl-1-phenyl-3-(triethylazaniumyl)propan-1-olate Traditional Name: 1-cyclohexyl-1-phenyl-3-(triethylammonio)propan-1-olate Formula: C21H35NO MolecularWeight: 317.5087

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H35NO/c1-4-22(5-2,6-3)18-17-21(23,19-13-9-7-10-14-19)20-15-11-8-12-16-20/h7,9-10,13-14,20H,4-6,8,11-12,15-18H2,1-3H3