(2S)-2-azanyl-3-[5-iodanyl-2,4-bis(oxidanylidene)-3-[2-(2H-1,2,3,4-tetrazol-5-yl)ethyl]pyrimidin-1-yl]propanoic acid

Systemtic Name: (2S)-2-azanyl-3-[5-iodanyl-2,4-bis(oxidanylidene)-3-[2-(2H-1,2,3,4-tetrazol-5-yl)ethyl]pyrimidin-1-yl]propanoic acid Openeye Name: (2S)-2-amino-3-[5-iodo-2,4-dioxo-3-[2-(2H-tetrazol-5-yl)ethyl]pyrimidin-1-yl]propanoic acid CAS Name: (2S)-2-amino-3-[5-iodo-2,4-dioxo-3-[2-(2H-tetrazol-5-yl)ethyl]-1-pyrimidinyl]propanoic acid IUPAC Name: (2S)-2-amino-3-[5-iodo-2,4-dioxo-3-[2-(2H-tetrazol-5-yl)ethyl]pyrimidin-1-yl]propanoic acid Traditional Name: (2S)-2-amino-3-[5-iodo-2,4-diketo-3-[2-(2H-tetrazol-5-yl)ethyl]pyrimidin-1-yl]propionic acid Formula: C10H12IN7O4 MolecularWeight: 421.15125

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=O)N(C(=O)N1CC(C(=O)O)N)CCC2=NNN=N2)I

Isomeric SMILES

C1=C(C(=O)N(C(=O)N1C[C@@H](C(=O)O)N)CCC2=NNN=N2)I

InChI

InChI=1S/C10H12IN7O4/c11-5-3-17(4-6(12)9(20)21)10(22)18(8(5)19)2-1-7-13-15-16-14-7/h3,6H,1-2,4,12H2,(H,20,21)(H,13,14,15,16)/t6-/m0/s1