2-[[2-ethoxy-3,4-bis(oxidanylidene)cyclobuten-1-yl]amino]ethylphosphonic acid

Systemtic Name: 2-[[2-ethoxy-3,4-bis(oxidanylidene)cyclobuten-1-yl]amino]ethylphosphonic acid Openeye Name: 2-[(2-ethoxy-3,4-dioxo-cyclobuten-1-yl)amino]ethylphosphonic acid CAS Name: 2-[(2-ethoxy-3,4-dioxo-1-cyclobutenyl)amino]ethylphosphonic acid IUPAC Name: 2-[(2-ethoxy-3,4-dioxocyclobuten-1-yl)amino]ethylphosphonic acid Traditional Name: 2-[(2-ethoxy-3,4-diketo-cyclobuten-1-yl)amino]ethylphosphonic acid Formula: C8H12NO6P MolecularWeight: 249.157741

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=O)C1=O)NCCP(=O)(O)O

Isomeric SMILES

CCOC1=C(C(=O)C1=O)NCCP(=O)(O)O

InChI

InChI=1S/C8H12NO6P/c1-2-15-8-5(6(10)7(8)11)9-3-4-16(12,13)14/h9H,2-4H2,1H3,(H2,12,13,14)