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(3S)-3-azaniumyl-4-(4-tert-butylphenyl)butanoate

(3S)-3-azaniumyl-4-(4-tert-butylphenyl)butanoate

Systemtic Name:(3S)-3-azaniumyl-4-(4-tert-butylphenyl)butanoate
Openeye Name:(3S)-3-azaniumyl-4-(4-tert-butylphenyl)butanoate
CAS Name:(3S)-3-ammonio-4-(4-tert-butylphenyl)butanoate
IUPAC Name:(3S)-3-azaniumyl-4-(4-tert-butylphenyl)butanoate
Traditional Name:(3S)-3-ammonio-4-(4-tert-butylphenyl)butyrate
Formula: C14H21NO2
MolecularWeight: 235.32204
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CC(CC(=O)[O-])[NH3+]


Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C[C@@H](CC(=O)[O-])[NH3+]


InChI

InChI=1S/C14H21NO2/c1-14(2,3)11-6-4-10(5-7-11)8-12(15)9-13(16)17/h4-7,12H,8-9,15H2,1-3H3,(H,16,17)/t12-/m0/s1


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