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

Systemtic Name: 2-azanyl-4-[(E)-3-[3,4-bis(oxidanyl)phenyl]prop-2-enoyl]oxy-butanoic acid Openeye Name: 2-amino-4-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-butanoic acid CAS Name: 2-amino-4-[(E)-3-(3,4-dihydroxyphenyl)-1-oxoprop-2-enoxy]butanoic acid IUPAC Name: 2-amino-4-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxybutanoic acid Traditional Name: 2-amino-4-[(E)-3-(3,4-dihydroxyphenyl)acryloyl]oxy-butyric acid Formula: C13H15NO6 MolecularWeight: 281.2613

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15NO6/c14-9(13(18)19)5-6-20-12(17)4-2-8-1-3-10(15)11(16)7-8/h1-4,7,9,15-16H,5-6,14H2,(H,18,19)/b4-2+