2-[[cyclohexyl(methyl)azaniumyl]methyl]benzoate

Systemtic Name: 2-[[cyclohexyl(methyl)azaniumyl]methyl]benzoate Openeye Name: 2-[[cyclohexyl(methyl)ammonio]methyl]benzoate CAS Name: 2-[[cyclohexyl(methyl)ammonio]methyl]benzoate IUPAC Name: 2-[[cyclohexyl(methyl)azaniumyl]methyl]benzoate Traditional Name: 2-[[cyclohexyl(methyl)ammonio]methyl]benzoate Formula: C15H21NO2 MolecularWeight: 247.33274

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1C(=O)[O-])C2CCCCC2

Isomeric SMILES

C[NH+](CC1=CC=CC=C1C(=O)[O-])C2CCCCC2

InChI

InChI=1S/C15H21NO2/c1-16(13-8-3-2-4-9-13)11-12-7-5-6-10-14(12)15(17)18/h5-7,10,13H,2-4,8-9,11H2,1H3,(H,17,18)