(2S)-2-(2,3-dihydro-1,4-dioxin-5-ylcarbonylamino)-3-(1H-imidazol-5-yl)propanoic acid

Systemtic Name: (2S)-2-(2,3-dihydro-1,4-dioxin-5-ylcarbonylamino)-3-(1H-imidazol-5-yl)propanoic acid Openeye Name: (2S)-2-(2,3-dihydro-1,4-dioxine-5-carbonylamino)-3-(1H-imidazol-5-yl)propanoic acid CAS Name: (2S)-2-[[2,3-dihydro-1,4-dioxin-5-yl(oxo)methyl]amino]-3-(1H-imidazol-5-yl)propanoic acid IUPAC Name: (2S)-2-(2,3-dihydro-1,4-dioxine-5-carbonylamino)-3-(1H-imidazol-5-yl)propanoic acid Traditional Name: (2S)-2-(2,3-dihydro-p-dioxin-5-carbonylamino)-3-(1H-imidazol-5-yl)propionic acid Formula: C11H13N3O5 MolecularWeight: 267.23802

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(=CO1)C(=O)NC(CC2=CN=CN2)C(=O)O

Isomeric SMILES

C1COC(=CO1)C(=O)N[C@@H](CC2=CN=CN2)C(=O)O

InChI

InChI=1S/C11H13N3O5/c15-10(9-5-18-1-2-19-9)14-8(11(16)17)3-7-4-12-6-13-7/h4-6,8H,1-3H2,(H,12,13)(H,14,15)(H,16,17)/t8-/m0/s1