2-[[[(Z)-3-(6-chloranylpurin-9-yl)prop-2-enoxy]-oxidanyl-phosphoryl]amino]propanoic acid

Systemtic Name: 2-[[[(Z)-3-(6-chloranylpurin-9-yl)prop-2-enoxy]-oxidanyl-phosphoryl]amino]propanoic acid Openeye Name: 2-[[[(Z)-3-(6-chloropurin-9-yl)allyloxy]-hydroxy-phosphoryl]amino]propanoic acid CAS Name: 2-[[[(Z)-3-(6-chloro-9-purinyl)prop-2-enoxy]-hydroxyphosphoryl]amino]propanoic acid IUPAC Name: 2-[[[(Z)-3-(6-chloropurin-9-yl)prop-2-enoxy]-hydroxyphosphoryl]amino]propanoic acid Traditional Name: 2-[[[(Z)-3-(6-chloropurin-9-yl)allyloxy]-hydroxy-phosphoryl]amino]propionic acid Formula: C11H13ClN5O5P MolecularWeight: 361.678181

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NP(=O)(O)OCC=CN1C=NC2=C1N=CN=C2Cl

Isomeric SMILES

CC(C(=O)O)NP(=O)(O)OC/C=C\N1C=NC2=C1N=CN=C2Cl

InChI

InChI=1S/C11H13ClN5O5P/c1-7(11(18)19)16-23(20,21)22-4-2-3-17-6-15-8-9(12)13-5-14-10(8)17/h2-3,5-7H,4H2,1H3,(H,18,19)(H2,16,20,21)/b3-2-