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

Systemtic Name: (2S)-2-(methylcarbamoylamino)-3-(5-oxidanyl-1H-indol-3-yl)propanoic acid Openeye Name: (2S)-3-(5-hydroxy-1H-indol-3-yl)-2-(methylcarbamoylamino)propanoic acid CAS Name: (2S)-3-(5-hydroxy-1H-indol-3-yl)-2-(methylcarbamoylamino)propanoic acid IUPAC Name: (2S)-3-(5-hydroxy-1H-indol-3-yl)-2-(methylcarbamoylamino)propanoic acid Traditional Name: (2S)-3-(5-hydroxy-1H-indol-3-yl)-2-(methylcarbamoylamino)propionic acid Formula: C13H15N3O4 MolecularWeight: 277.2759

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)NC(CC1=CNC2=C1C=C(C=C2)O)C(=O)O

Isomeric SMILES

CNC(=O)N[C@@H](CC1=CNC2=C1C=C(C=C2)O)C(=O)O

InChI

InChI=1S/C13H15N3O4/c1-14-13(20)16-11(12(18)19)4-7-6-15-10-3-2-8(17)5-9(7)10/h2-3,5-6,11,15,17H,4H2,1H3,(H,18,19)(H2,14,16,20)/t11-/m0/s1