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

Systemtic Name: [(6-propan-2-yloxycarbonyl-1,3-benzothiazol-2-yl)carbamoylamino]phosphonic acid Openeye Name: [(6-isopropoxycarbonyl-1,3-benzothiazol-2-yl)carbamoylamino]phosphonic acid CAS Name: [[oxo-[[6-[oxo(propan-2-yloxy)methyl]-1,3-benzothiazol-2-yl]amino]methyl]amino]phosphonic acid IUPAC Name: [(6-propan-2-yloxycarbonyl-1,3-benzothiazol-2-yl)carbamoylamino]phosphonic acid Traditional Name: [(6-isopropoxycarbonyl-1,3-benzothiazol-2-yl)carbamoylamino]phosphonic acid Formula: C12H14N3O6PS MolecularWeight: 359.294821

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)NP(=O)(O)O

Isomeric SMILES

CC(C)OC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)NP(=O)(O)O

InChI

InChI=1S/C12H14N3O6PS/c1-6(2)21-10(16)7-3-4-8-9(5-7)23-12(13-8)14-11(17)15-22(18,19)20/h3-6H,1-2H3,(H4,13,14,15,17,18,19,20)