4-[[3-(4-hydroxyphenyl)-1-oxidanyl-1-oxidanylidene-propan-2-yl]amino]-3-methyl-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[3-(4-hydroxyphenyl)-1-oxidanyl-1-oxidanylidene-propan-2-yl]amino]-3-methyl-4-oxidanylidene-butanoic acid Openeye Name: 4-[[2-hydroxy-1-[(4-hydroxyphenyl)methyl]-2-oxo-ethyl]amino]-3-methyl-4-oxo-butanoic acid CAS Name: 4-[[1-hydroxy-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]amino]-3-methyl-4-oxobutanoic acid IUPAC Name: 4-[[1-hydroxy-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]amino]-3-methyl-4-oxobutanoic acid Traditional Name: 4-[[2-hydroxy-1-(4-hydroxybenzyl)-2-keto-ethyl]amino]-4-keto-3-methyl-butyric acid Formula: C14H17NO6 MolecularWeight: 295.28788

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)O)C(=O)NC(CC1=CC=C(C=C1)O)C(=O)O

Isomeric SMILES

CC(CC(=O)O)C(=O)NC(CC1=CC=C(C=C1)O)C(=O)O

InChI

InChI=1S/C14H17NO6/c1-8(6-12(17)18)13(19)15-11(14(20)21)7-9-2-4-10(16)5-3-9/h2-5,8,11,16H,6-7H2,1H3,(H,15,19)(H,17,18)(H,20,21)