(E)-3-(5-azanyl-2-oxidanyl-phenyl)-N-[1,3-bis(oxidanyl)propan-2-yl]prop-2-enamide

Systemtic Name: (E)-3-(5-azanyl-2-oxidanyl-phenyl)-N-[1,3-bis(oxidanyl)propan-2-yl]prop-2-enamide Openeye Name: (E)-3-(5-amino-2-hydroxy-phenyl)-N-[2-hydroxy-1-(hydroxymethyl)ethyl]prop-2-enamide CAS Name: (E)-3-(5-amino-2-hydroxyphenyl)-N-(1,3-dihydroxypropan-2-yl)-2-propenamide IUPAC Name: (E)-3-(5-amino-2-hydroxyphenyl)-N-(1,3-dihydroxypropan-2-yl)prop-2-enamide Traditional Name: (E)-3-(5-amino-2-hydroxy-phenyl)-N-(2-hydroxy-1-methylol-ethyl)acrylamide Formula: C12H16N2O4 MolecularWeight: 252.26644

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N)C=CC(=O)NC(CO)CO)O

Isomeric SMILES

C1=CC(=C(C=C1N)/C=C/C(=O)NC(CO)CO)O

InChI

InChI=1S/C12H16N2O4/c13-9-2-3-11(17)8(5-9)1-4-12(18)14-10(6-15)7-16/h1-5,10,15-17H,6-7,13H2,(H,14,18)/b4-1+