2-[cyclohexyl-(phenylmethyl)azaniumyl]ethanoate

Systemtic Name: 2-[cyclohexyl-(phenylmethyl)azaniumyl]ethanoate Openeye Name: 2-[benzyl(cyclohexyl)ammonio]acetate CAS Name: 2-[cyclohexyl-(phenylmethyl)ammonio]acetate IUPAC Name: 2-[benzyl(cyclohexyl)azaniumyl]acetate Traditional Name: 2-[benzyl(cyclohexyl)ammonio]acetate Formula: C15H21NO2 MolecularWeight: 247.33274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)[NH+](CC2=CC=CC=C2)CC(=O)[O-]

Isomeric SMILES

C1CCC(CC1)[NH+](CC2=CC=CC=C2)CC(=O)[O-]

InChI

InChI=1S/C15H21NO2/c17-15(18)12-16(14-9-5-2-6-10-14)11-13-7-3-1-4-8-13/h1,3-4,7-8,14H,2,5-6,9-12H2,(H,17,18)