2-[(4-tert-butylphenyl)methyl-ethyl-azaniumyl]ethanoate

Systemtic Name: 2-[(4-tert-butylphenyl)methyl-ethyl-azaniumyl]ethanoate Openeye Name: 2-[(4-tert-butylphenyl)methyl-ethyl-ammonio]acetate CAS Name: 2-[(4-tert-butylphenyl)methyl-ethylammonio]acetate IUPAC Name: 2-[(4-tert-butylphenyl)methyl-ethylazaniumyl]acetate Traditional Name: 2-[(4-tert-butylbenzyl)-ethyl-ammonio]acetate Formula: C15H23NO2 MolecularWeight: 249.34862

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H23NO2/c1-5-16(11-14(17)18)10-12-6-8-13(9-7-12)15(2,3)4/h6-9H,5,10-11H2,1-4H3,(H,17,18)