(2S)-2-(azaniumylmethyl)-3-(4-methoxyphenyl)propanoate

Systemtic Name: (2S)-2-(azaniumylmethyl)-3-(4-methoxyphenyl)propanoate Openeye Name: (2S)-2-(azaniumylmethyl)-3-(4-methoxyphenyl)propanoate CAS Name: (2S)-2-(ammoniomethyl)-3-(4-methoxyphenyl)propanoate IUPAC Name: (2S)-2-(azaniumylmethyl)-3-(4-methoxyphenyl)propanoate Traditional Name: (2S)-2-(ammoniomethyl)-3-(4-methoxyphenyl)propionate Formula: C11H15NO3 MolecularWeight: 209.2417

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(C[NH3+])C(=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C[C@@H](C[NH3+])C(=O)[O-]

InChI

InChI=1S/C11H15NO3/c1-15-10-4-2-8(3-5-10)6-9(7-12)11(13)14/h2-5,9H,6-7,12H2,1H3,(H,13,14)/t9-/m0/s1