(2S)-2-(ethenoxycarbonylamino)-3-(1H-indol-3-yl)propanoic acid

Systemtic Name: (2S)-2-(ethenoxycarbonylamino)-3-(1H-indol-3-yl)propanoic acid Openeye Name: (2S)-3-(1H-indol-3-yl)-2-(vinyloxycarbonylamino)propanoic acid CAS Name: (2S)-2-[[ethenoxy(oxo)methyl]amino]-3-(1H-indol-3-yl)propanoic acid IUPAC Name: (2S)-2-(ethenoxycarbonylamino)-3-(1H-indol-3-yl)propanoic acid Traditional Name: (2S)-3-(1H-indol-3-yl)-2-(vinyloxycarbonylamino)propionic acid Formula: C14H14N2O4 MolecularWeight: 274.27196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=COC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)O

Isomeric SMILES

C=COC(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)O

InChI

InChI=1S/C14H14N2O4/c1-2-20-14(19)16-12(13(17)18)7-9-8-15-11-6-4-3-5-10(9)11/h2-6,8,12,15H,1,7H2,(H,16,19)(H,17,18)/t12-/m0/s1