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

Systemtic Name: 4-[[2-azanyl-3,4-bis(oxidanylidene)cyclobuten-1-yl]amino]butylphosphonic acid Openeye Name: 4-[(2-amino-3,4-dioxo-cyclobuten-1-yl)amino]butylphosphonic acid CAS Name: 4-[(2-amino-3,4-dioxo-1-cyclobutenyl)amino]butylphosphonic acid IUPAC Name: 4-[(2-amino-3,4-dioxocyclobuten-1-yl)amino]butylphosphonic acid Traditional Name: 4-[(2-amino-3,4-diketo-cyclobuten-1-yl)amino]butylphosphonic acid Formula: C8H13N2O5P MolecularWeight: 248.172981

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Descriptors Computed from Structure

Canonical SMILES:

C(CCP(=O)(O)O)CNC1=C(C(=O)C1=O)N

Isomeric SMILES

C(CCP(=O)(O)O)CNC1=C(C(=O)C1=O)N

InChI

InChI=1S/C8H13N2O5P/c9-5-6(8(12)7(5)11)10-3-1-2-4-16(13,14)15/h10H,1-4,9H2,(H2,13,14,15)