3-[4-[2,5-bis(oxidanylidene)pyrrol-3-yl]phenyl]propanoic acid

Systemtic Name: 3-[4-[2,5-bis(oxidanylidene)pyrrol-3-yl]phenyl]propanoic acid Openeye Name: 3-[4-(2,5-dioxopyrrol-3-yl)phenyl]propanoic acid CAS Name: 3-[4-(2,5-dioxo-3-pyrrolyl)phenyl]propanoic acid IUPAC Name: 3-[4-(2,5-dioxopyrrol-3-yl)phenyl]propanoic acid Traditional Name: 3-[4-(2,5-diketo-3-pyrrolin-3-yl)phenyl]propionic acid Formula: C13H11NO4 MolecularWeight: 245.23074

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCC(=O)O)C2=CC(=O)NC2=O

Isomeric SMILES

C1=CC(=CC=C1CCC(=O)O)C2=CC(=O)NC2=O

InChI

InChI=1S/C13H11NO4/c15-11-7-10(13(18)14-11)9-4-1-8(2-5-9)3-6-12(16)17/h1-2,4-5,7H,3,6H2,(H,16,17)(H,14,15,18)