2-[(3-tert-butyl-5-methoxycarbonyl-phenyl)methyl]-3-(oxidanylamino)-3-oxidanylidene-propanoic acid

Systemtic Name: 2-[(3-tert-butyl-5-methoxycarbonyl-phenyl)methyl]-3-(oxidanylamino)-3-oxidanylidene-propanoic acid Openeye Name: 2-[(3-tert-butyl-5-methoxycarbonyl-phenyl)methyl]-3-(hydroxyamino)-3-oxo-propanoic acid CAS Name: 2-[(3-tert-butyl-5-methoxycarbonylphenyl)methyl]-3-(hydroxyamino)-3-oxopropanoic acid IUPAC Name: 2-[(3-tert-butyl-5-methoxycarbonylphenyl)methyl]-3-(hydroxyamino)-3-oxopropanoic acid Traditional Name: 2-(3-tert-butyl-5-carbomethoxy-benzyl)-3-(hydroxyamino)-3-keto-propionic acid Formula: C16H21NO6 MolecularWeight: 323.34104

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1)CC(C(=O)NO)C(=O)O)C(=O)OC

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1)CC(C(=O)NO)C(=O)O)C(=O)OC

InChI

InChI=1S/C16H21NO6/c1-16(2,3)11-6-9(5-10(8-11)15(21)23-4)7-12(14(19)20)13(18)17-22/h5-6,8,12,22H,7H2,1-4H3,(H,17,18)(H,19,20)