(2S)-3-(4-aminophenyl)-2-(prop-2-enoxycarbonylamino)propanoic acid

Systemtic Name: (2S)-3-(4-aminophenyl)-2-(prop-2-enoxycarbonylamino)propanoic acid Openeye Name: (2S)-2-(allyloxycarbonylamino)-3-(4-aminophenyl)propanoic acid CAS Name: (2S)-3-(4-aminophenyl)-2-[[oxo(prop-2-enoxy)methyl]amino]propanoic acid IUPAC Name: (2S)-3-(4-aminophenyl)-2-(prop-2-enoxycarbonylamino)propanoic acid Traditional Name: (2S)-2-(allyloxycarbonylamino)-3-(4-aminophenyl)propionic acid Formula: C13H16N2O4 MolecularWeight: 264.27714

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(=O)NC(CC1=CC=C(C=C1)N)C(=O)O

Isomeric SMILES

C=CCOC(=O)N[C@@H](CC1=CC=C(C=C1)N)C(=O)O

InChI

InChI=1S/C13H16N2O4/c1-2-7-19-13(18)15-11(12(16)17)8-9-3-5-10(14)6-4-9/h2-6,11H,1,7-8,14H2,(H,15,18)(H,16,17)/t11-/m0/s1