(2S)-2-(2-azaniumylethanoylamino)-3-(4-hydroxyphenyl)propanoate

Systemtic Name: (2S)-2-(2-azaniumylethanoylamino)-3-(4-hydroxyphenyl)propanoate Openeye Name: (2S)-2-[(2-azaniumylacetyl)amino]-3-(4-hydroxyphenyl)propanoate CAS Name: (2S)-2-[(2-ammonio-1-oxoethyl)amino]-3-(4-hydroxyphenyl)propanoate IUPAC Name: (2S)-2-[(2-azaniumylacetyl)amino]-3-(4-hydroxyphenyl)propanoate Traditional Name: (2S)-2-[(2-ammonioacetyl)amino]-3-(4-hydroxyphenyl)propionate Formula: C11H14N2O4 MolecularWeight: 238.23986

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(C(=O)[O-])NC(=O)C[NH3+])O

Isomeric SMILES

C1=CC(=CC=C1C[C@@H](C(=O)[O-])NC(=O)C[NH3+])O

InChI

InChI=1S/C11H14N2O4/c12-6-10(15)13-9(11(16)17)5-7-1-3-8(14)4-2-7/h1-4,9,14H,5-6,12H2,(H,13,15)(H,16,17)/t9-/m0/s1