[(6-nitro-1,3-benzothiazol-2-yl)carbamoylamino]phosphonic acid

Systemtic Name: [(6-nitro-1,3-benzothiazol-2-yl)carbamoylamino]phosphonic acid Openeye Name: [(6-nitro-1,3-benzothiazol-2-yl)carbamoylamino]phosphonic acid CAS Name: [[[(6-nitro-1,3-benzothiazol-2-yl)amino]-oxomethyl]amino]phosphonic acid IUPAC Name: [(6-nitro-1,3-benzothiazol-2-yl)carbamoylamino]phosphonic acid Traditional Name: [(6-nitro-1,3-benzothiazol-2-yl)carbamoylamino]phosphonic acid Formula: C8H7N4O6PS MolecularWeight: 318.203141

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])SC(=N2)NC(=O)NP(=O)(O)O

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])SC(=N2)NC(=O)NP(=O)(O)O

InChI

InChI=1S/C8H7N4O6PS/c13-7(11-19(16,17)18)10-8-9-5-2-1-4(12(14)15)3-6(5)20-8/h1-3H,(H4,9,10,11,13,16,17,18)