2-[5-oxidanylidene-2-(4-pyridin-4-ylphenyl)cyclopenten-1-yl]ethanoic acid

Systemtic Name: 2-[5-oxidanylidene-2-(4-pyridin-4-ylphenyl)cyclopenten-1-yl]ethanoic acid Openeye Name: 2-[5-oxo-2-[4-(4-pyridyl)phenyl]cyclopenten-1-yl]acetic acid CAS Name: 2-[5-oxo-2-(4-pyridin-4-ylphenyl)-1-cyclopentenyl]acetic acid IUPAC Name: 2-[5-oxo-2-(4-pyridin-4-ylphenyl)cyclopenten-1-yl]acetic acid Traditional Name: 2-[5-keto-2-[4-(4-pyridyl)phenyl]cyclopenten-1-yl]acetic acid Formula: C18H15NO3 MolecularWeight: 293.3166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)C(=C1C2=CC=C(C=C2)C3=CC=NC=C3)CC(=O)O

Isomeric SMILES

C1CC(=O)C(=C1C2=CC=C(C=C2)C3=CC=NC=C3)CC(=O)O

InChI

InChI=1S/C18H15NO3/c20-17-6-5-15(16(17)11-18(21)22)14-3-1-12(2-4-14)13-7-9-19-10-8-13/h1-4,7-10H,5-6,11H2,(H,21,22)