2-azanyl-3-[(E)-3-[3,4-bis(oxidanyl)phenyl]prop-2-enoyl]oxy-propanoic acid

Systemtic Name: 2-azanyl-3-[(E)-3-[3,4-bis(oxidanyl)phenyl]prop-2-enoyl]oxy-propanoic acid Openeye Name: 2-amino-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-propanoic acid CAS Name: 2-amino-3-[(E)-3-(3,4-dihydroxyphenyl)-1-oxoprop-2-enoxy]propanoic acid IUPAC Name: 2-amino-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxypropanoic acid Traditional Name: 2-amino-3-[(E)-3-(3,4-dihydroxyphenyl)acryloyl]oxy-propionic acid Formula: C12H13NO6 MolecularWeight: 267.23472

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C=CC(=O)OCC(C(=O)O)N)O)O

Isomeric SMILES

C1=CC(=C(C=C1/C=C/C(=O)OCC(C(=O)O)N)O)O

InChI

InChI=1S/C12H13NO6/c13-8(12(17)18)6-19-11(16)4-2-7-1-3-9(14)10(15)5-7/h1-5,8,14-15H,6,13H2,(H,17,18)/b4-2+