3-[(4-tert-butylphenyl)methylazaniumyl]propanoate

Systemtic Name: 3-[(4-tert-butylphenyl)methylazaniumyl]propanoate Openeye Name: 3-[(4-tert-butylphenyl)methylammonio]propanoate CAS Name: 3-[(4-tert-butylphenyl)methylammonio]propanoate IUPAC Name: 3-[(4-tert-butylphenyl)methylazaniumyl]propanoate Traditional Name: 3-[(4-tert-butylbenzyl)ammonio]propionate Formula: C14H21NO2 MolecularWeight: 235.32204

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C[NH2+]CCC(=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C[NH2+]CCC(=O)[O-]

InChI

InChI=1S/C14H21NO2/c1-14(2,3)12-6-4-11(5-7-12)10-15-9-8-13(16)17/h4-7,15H,8-10H2,1-3H3,(H,16,17)