1-[[2-(2-azanylpropanoylamino)-3-(1H-imidazol-5-yl)propanoyl]amino]ethylphosphonic acid

Systemtic Name: 1-[[2-(2-azanylpropanoylamino)-3-(1H-imidazol-5-yl)propanoyl]amino]ethylphosphonic acid Openeye Name: 1-[[2-(2-aminopropanoylamino)-3-(1H-imidazol-5-yl)propanoyl]amino]ethylphosphonic acid CAS Name: 1-[[2-[(2-amino-1-oxopropyl)amino]-3-(1H-imidazol-5-yl)-1-oxopropyl]amino]ethylphosphonic acid IUPAC Name: 1-[[2-(2-aminopropanoylamino)-3-(1H-imidazol-5-yl)propanoyl]amino]ethylphosphonic acid Traditional Name: 1-[[2-(alanylamino)-3-(1H-imidazol-5-yl)propanoyl]amino]ethylphosphonic acid Formula: C11H20N5O5P MolecularWeight: 333.280761

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(CC1=CN=CN1)C(=O)NC(C)P(=O)(O)O)N

Isomeric SMILES

CC(C(=O)NC(CC1=CN=CN1)C(=O)NC(C)P(=O)(O)O)N

InChI

InChI=1S/C11H20N5O5P/c1-6(12)10(17)16-9(3-8-4-13-5-14-8)11(18)15-7(2)22(19,20)21/h4-7,9H,3,12H2,1-2H3,(H,13,14)(H,15,18)(H,16,17)(H2,19,20,21)