(5R)-5-azaniumyl-5-(4-ethylphenyl)pentanoate

Systemtic Name: (5R)-5-azaniumyl-5-(4-ethylphenyl)pentanoate Openeye Name: (5R)-5-azaniumyl-5-(4-ethylphenyl)pentanoate CAS Name: (5R)-5-ammonio-5-(4-ethylphenyl)pentanoate IUPAC Name: (5R)-5-azaniumyl-5-(4-ethylphenyl)pentanoate Traditional Name: (5R)-5-ammonio-5-(4-ethylphenyl)valerate Formula: C13H19NO2 MolecularWeight: 221.29546

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(CCCC(=O)[O-])[NH3+]

Isomeric SMILES

CCC1=CC=C(C=C1)[C@@H](CCCC(=O)[O-])[NH3+]

InChI

InChI=1S/C13H19NO2/c1-2-10-6-8-11(9-7-10)12(14)4-3-5-13(15)16/h6-9,12H,2-5,14H2,1H3,(H,15,16)/t12-/m1/s1