3-(1H-imidazol-5-yl)-2-[(4-methoxy-2-methyl-4-oxidanylidene-butanoyl)amino]propanoic acid

Systemtic Name: 3-(1H-imidazol-5-yl)-2-[(4-methoxy-2-methyl-4-oxidanylidene-butanoyl)amino]propanoic acid Openeye Name: 3-(1H-imidazol-5-yl)-2-[(4-methoxy-2-methyl-4-oxo-butanoyl)amino]propanoic acid CAS Name: 3-(1H-imidazol-5-yl)-2-[(4-methoxy-2-methyl-1,4-dioxobutyl)amino]propanoic acid IUPAC Name: 3-(1H-imidazol-5-yl)-2-[(4-methoxy-2-methyl-4-oxobutanoyl)amino]propanoic acid Traditional Name: 3-(1H-imidazol-5-yl)-2-[(4-keto-4-methoxy-2-methyl-butanoyl)amino]propionic acid Formula: C12H17N3O5 MolecularWeight: 283.28048

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)OC)C(=O)NC(CC1=CN=CN1)C(=O)O

Isomeric SMILES

CC(CC(=O)OC)C(=O)NC(CC1=CN=CN1)C(=O)O

InChI

InChI=1S/C12H17N3O5/c1-7(3-10(16)20-2)11(17)15-9(12(18)19)4-8-5-13-6-14-8/h5-7,9H,3-4H2,1-2H3,(H,13,14)(H,15,17)(H,18,19)