aluminum 2-(3-acetamidopropanoylamino)-3-(1H-imidazol-5-yl)propanoic acid trihydroxide

Systemtic Name: aluminum 2-(3-acetamidopropanoylamino)-3-(1H-imidazol-5-yl)propanoic acid trihydroxide Openeye Name: aluminum 2-(3-acetamidopropanoylamino)-3-(1H-imidazol-5-yl)propanoic acid trihydroxide CAS Name: aluminum 2-[(3-acetamido-1-oxopropyl)amino]-3-(1H-imidazol-5-yl)propanoic acid trihydroxide IUPAC Name: aluminum 2-(3-acetamidopropanoylamino)-3-(1H-imidazol-5-yl)propanoic acid trihydroxide Traditional Name: aluminum 2-(3-acetamidopropanoylamino)-3-(1H-imidazol-5-yl)propionic acid trihydroxide Formula: C11H19AlN4O7 MolecularWeight: 346.272698

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCC(=O)NC(CC1=CN=CN1)C(=O)O.[OH-].[OH-].[OH-].[Al+3]

Isomeric SMILES

CC(=O)NCCC(=O)NC(CC1=CN=CN1)C(=O)O.[OH-].[OH-].[OH-].[Al+3]

InChI

InChI=1S/C11H16N4O4.Al.3H2O/c1-7(16)13-3-2-10(17)15-9(11(18)19)4-8-5-12-6-14-8;;;;/h5-6,9H,2-4H2,1H3,(H,12,14)(H,13,16)(H,15,17)(H,18,19);;3*1H2/q;+3;;;/p-3