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

Systemtic Name: 2-acetamido-3-[(E)-3-[3,4-bis(oxidanyl)phenyl]prop-2-enoyl]oxy-propanoic acid Openeye Name: 2-acetamido-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-propanoic acid CAS Name: 2-acetamido-3-[(E)-3-(3,4-dihydroxyphenyl)-1-oxoprop-2-enoxy]propanoic acid IUPAC Name: 2-acetamido-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxypropanoic acid Traditional Name: 2-acetamido-3-[(E)-3-(3,4-dihydroxyphenyl)acryloyl]oxy-propionic acid Formula: C14H15NO7 MolecularWeight: 309.2714

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(=O)NC(COC(=O)/C=C/C1=CC(=C(C=C1)O)O)C(=O)O

InChI

InChI=1S/C14H15NO7/c1-8(16)15-10(14(20)21)7-22-13(19)5-3-9-2-4-11(17)12(18)6-9/h2-6,10,17-18H,7H2,1H3,(H,15,16)(H,20,21)/b5-3+