2,2-dimethyl-3-[(phenylmethyl)-propan-2-yl-azaniumyl]propanoate

Systemtic Name: 2,2-dimethyl-3-[(phenylmethyl)-propan-2-yl-azaniumyl]propanoate Openeye Name: 3-[benzyl(isopropyl)ammonio]-2,2-dimethyl-propanoate CAS Name: 2,2-dimethyl-3-[(phenylmethyl)-propan-2-ylammonio]propanoate IUPAC Name: 3-[benzyl(propan-2-yl)azaniumyl]-2,2-dimethylpropanoate Traditional Name: 3-[benzyl(isopropyl)ammonio]-2,2-dimethyl-propionate Formula: C15H23NO2 MolecularWeight: 249.34862

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](CC1=CC=CC=C1)CC(C)(C)C(=O)[O-]

Isomeric SMILES

CC(C)[NH+](CC1=CC=CC=C1)CC(C)(C)C(=O)[O-]

InChI

InChI=1S/C15H23NO2/c1-12(2)16(11-15(3,4)14(17)18)10-13-8-6-5-7-9-13/h5-9,12H,10-11H2,1-4H3,(H,17,18)