3-[3,4-bis(oxidanyl)phenyl]-2-(ethynylamino)propanoic acid

Systemtic Name: 3-[3,4-bis(oxidanyl)phenyl]-2-(ethynylamino)propanoic acid Openeye Name: 3-(3,4-dihydroxyphenyl)-2-(ethynylamino)propanoic acid CAS Name: 3-(3,4-dihydroxyphenyl)-2-(ethynylamino)propanoic acid IUPAC Name: 3-(3,4-dihydroxyphenyl)-2-(ethynylamino)propanoic acid Traditional Name: 3-(3,4-dihydroxyphenyl)-2-(ethynylamino)propionic acid Formula: C11H11NO4 MolecularWeight: 221.20934

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Descriptors Computed from Structure

Canonical SMILES:

C#CNC(CC1=CC(=C(C=C1)O)O)C(=O)O

Isomeric SMILES

C#CNC(CC1=CC(=C(C=C1)O)O)C(=O)O

InChI

InChI=1S/C11H11NO4/c1-2-12-8(11(15)16)5-7-3-4-9(13)10(14)6-7/h1,3-4,6,8,12-14H,5H2,(H,15,16)