4-(6-oxidanylidenecyclohexa-2,4-dien-1-yl)oxybutylphosphonic acid

Systemtic Name: 4-(6-oxidanylidenecyclohexa-2,4-dien-1-yl)oxybutylphosphonic acid Openeye Name: 4-(6-oxocyclohexa-2,4-dien-1-yl)oxybutylphosphonic acid CAS Name: 4-[(6-oxo-1-cyclohexa-2,4-dienyl)oxy]butylphosphonic acid IUPAC Name: 4-(6-oxocyclohexa-2,4-dien-1-yl)oxybutylphosphonic acid Traditional Name: 4-(6-ketocyclohexa-2,4-dien-1-yl)oxybutylphosphonic acid Formula: C10H15O5P MolecularWeight: 246.196861

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(C(=O)C=C1)OCCCCP(=O)(O)O

Isomeric SMILES

C1=CC(C(=O)C=C1)OCCCCP(=O)(O)O

InChI

InChI=1S/C10H15O5P/c11-9-5-1-2-6-10(9)15-7-3-4-8-16(12,13)14/h1-2,5-6,10H,3-4,7-8H2,(H2,12,13,14)