2-[4-(3-oxidanylidenecyclohexen-1-yl)phenyl]propanoic acid

Systemtic Name: 2-[4-(3-oxidanylidenecyclohexen-1-yl)phenyl]propanoic acid Openeye Name: 2-[4-(3-oxocyclohexen-1-yl)phenyl]propanoic acid CAS Name: 2-[4-(3-oxo-1-cyclohexenyl)phenyl]propanoic acid IUPAC Name: 2-[4-(3-oxocyclohexen-1-yl)phenyl]propanoic acid Traditional Name: 2-[4-(3-ketocyclohexen-1-yl)phenyl]propionic acid Formula: C15H16O3 MolecularWeight: 244.28574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)C2=CC(=O)CCC2)C(=O)O

Isomeric SMILES

CC(C1=CC=C(C=C1)C2=CC(=O)CCC2)C(=O)O

InChI

InChI=1S/C15H16O3/c1-10(15(17)18)11-5-7-12(8-6-11)13-3-2-4-14(16)9-13/h5-10H,2-4H2,1H3,(H,17,18)