(2S)-2-(aminocarbonylamino)-3-(5-oxidanyl-1H-indol-3-yl)propanoic acid

Systemtic Name: (2S)-2-(aminocarbonylamino)-3-(5-oxidanyl-1H-indol-3-yl)propanoic acid Openeye Name: (2S)-3-(5-hydroxy-1H-indol-3-yl)-2-ureido-propanoic acid CAS Name: (2S)-2-(carbamoylamino)-3-(5-hydroxy-1H-indol-3-yl)propanoic acid IUPAC Name: (2S)-2-(carbamoylamino)-3-(5-hydroxy-1H-indol-3-yl)propanoic acid Traditional Name: (2S)-3-(5-hydroxy-1H-indol-3-yl)-2-ureido-propionic acid Formula: C12H13N3O4 MolecularWeight: 263.24932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1O)C(=CN2)CC(C(=O)O)NC(=O)N

Isomeric SMILES

C1=CC2=C(C=C1O)C(=CN2)C[C@@H](C(=O)O)NC(=O)N

InChI

InChI=1S/C12H13N3O4/c13-12(19)15-10(11(17)18)3-6-5-14-9-2-1-7(16)4-8(6)9/h1-2,4-5,10,14,16H,3H2,(H,17,18)(H3,13,15,19)/t10-/m0/s1