3-(ethoxycarbonylamino)-4-(4-hydroxyphenyl)-2-oxidanyl-4-oxidanylidene-butanoic acid

Systemtic Name: 3-(ethoxycarbonylamino)-4-(4-hydroxyphenyl)-2-oxidanyl-4-oxidanylidene-butanoic acid Openeye Name: 3-(ethoxycarbonylamino)-2-hydroxy-4-(4-hydroxyphenyl)-4-oxo-butanoic acid CAS Name: 3-(ethoxycarbonylamino)-2-hydroxy-4-(4-hydroxyphenyl)-4-oxobutanoic acid IUPAC Name: 3-(ethoxycarbonylamino)-2-hydroxy-4-(4-hydroxyphenyl)-4-oxobutanoic acid Traditional Name: 3-(carbethoxyamino)-2-hydroxy-4-(4-hydroxyphenyl)-4-keto-butyric acid Formula: C13H15NO7 MolecularWeight: 297.2607

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(C(C(=O)O)O)C(=O)C1=CC=C(C=C1)O

Isomeric SMILES

CCOC(=O)NC(C(C(=O)O)O)C(=O)C1=CC=C(C=C1)O

InChI

InChI=1S/C13H15NO7/c1-2-21-13(20)14-9(11(17)12(18)19)10(16)7-3-5-8(15)6-4-7/h3-6,9,11,15,17H,2H2,1H3,(H,14,20)(H,18,19)